data_1uw0_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 1uw0 _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 ' 4' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.79 126.37 52.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.184 -0.948 . . . . 0.0 110.145 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.7 m-85 -120.77 142.8 49.22 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.27 -0.894 . . . . 0.0 110.186 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -133.96 158.92 42.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.2 -0.937 . . . . 0.0 110.158 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.4 t -116.81 125.76 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.149 -0.969 . . . . 0.0 110.05 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -142.61 158.46 43.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.147 -0.971 . . . . 0.0 110.668 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.446 ' OH ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -106.84 148.51 28.45 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.462 -0.774 . . . . 0.0 110.026 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.71 135.89 57.79 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.218 -0.927 . . . . 0.0 109.809 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -114.32 -56.44 2.39 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 110.291 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -153.36 130.97 11.48 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.181 -0.949 . . . . 0.0 110.655 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.85 158.19 23.43 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.0 p -118.14 136.98 53.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.208 -1.172 . . . . 0.0 110.063 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -129.07 132.17 47.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.126 -0.984 . . . . 0.0 110.483 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.01 111.27 3.96 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.9 t -65.15 157.76 27.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.26 -1.141 . . . . 0.0 109.182 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -87.63 155.54 19.9 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.584 -0.697 . . . . 0.0 110.197 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.54 28.26 4.64 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.266 -0.896 . . . . 0.0 111.914 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 p -172.1 163.82 6.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.787 -1.195 . . . . 0.0 111.295 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.74 53.64 0.86 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -136.03 -174.63 3.72 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.481 -0.762 . . . . 0.0 110.355 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.6 pttt -139.05 156.44 47.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.405 HD12 HG22 ' A' ' 25' ' ' ILE . 41.3 mt -95.52 105.32 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.368 -0.833 . . . . 0.0 109.564 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.4 t -108.57 162.75 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.241 -0.912 . . . . 0.0 109.931 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -41.07 126.22 2.55 Favored 'General case' 0 N--CA 1.52 3.057 0 O-C-N 121.668 -0.645 . . . . 0.0 111.548 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 110.3 -3.84 29.78 Favored Glycine 0 N--CA 1.492 2.392 0 C-N-CA 120.111 -1.042 . . . . 0.0 111.125 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.1 t -110.48 134.12 53.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-N 119.564 1.682 . . . . 0.0 109.871 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.8 t -89.88 132.54 35.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.246 -0.909 . . . . 0.0 108.861 178.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.86 151.99 50.68 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.145 -0.972 . . . . 0.0 111.308 -178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.5 mt -103.71 139.59 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.419 -0.801 . . . . 0.0 109.078 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.17 128.1 9.41 Favored Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 29.7 tttt -110.41 114.96 28.81 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.277 -1.131 . . . . 0.0 109.738 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -98.72 107.76 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.199 -0.938 . . . . 0.0 110.419 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.3 p -124.69 143.14 42.64 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.268 -0.895 . . . . 0.0 109.934 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -76.11 127.56 10.02 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.261 1.137 . . . . 0.0 110.292 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m120 . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 179.752 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.454 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -116.46 137.28 52.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.186 -1.185 . . . . 0.0 110.166 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.3 ttt -116.97 152.28 34.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.234 -0.917 . . . . 0.0 110.244 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -125.03 145.16 50.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.266 -0.896 . . . . 0.0 110.617 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.28 156.62 43.7 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.0 109.652 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -101.55 142.3 33.13 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.15 -0.968 . . . . 0.0 110.127 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -121.3 174.14 6.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.314 -0.866 . . . . 0.0 110.718 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.8 m80 -93.65 -173.82 3.29 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.518 HG23 ' NE2' ' A' ' 93' ' ' HIS . 45.5 mm -83.27 -33.73 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.32 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -90.57 -33.89 15.71 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.771 -1.206 . . . . 0.0 110.686 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.2 m -63.24 -52.31 62.67 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.927 -1.108 . . . . 0.0 110.307 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.1 88.96 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.275 -0.891 . . . . 0.0 110.375 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.418 ' CE1' HG13 ' A' ' 94' ' ' ILE . 10.4 m-85 -75.17 -30.35 60.7 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.02 -1.072 . . . . 0.0 109.751 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -68.23 -36.18 79.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.981 -1.074 . . . . 0.0 109.564 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 41.2 tttm -59.97 -40.05 87.74 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.996 . . . . 0.0 109.761 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -59.89 -44.91 93.97 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.738 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -58.56 -35.1 71.84 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.212 -0.93 . . . . 0.0 110.436 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 ttt-85 -89.71 -29.2 18.91 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.18 -0.95 . . . . 0.0 111.01 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.509 2.512 0 O-C-N 120.826 -1.171 . . . . 0.0 110.186 -179.807 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.9 mtpt . . . . . 0 N--CA 1.493 1.72 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.413 HG22 HD11 ' A' ' 70' ' ' ILE . 79.4 mt 54.36 98.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.116 -0.99 . . . . 0.0 110.562 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -110.29 141.77 42.84 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.139 -0.976 . . . . 0.0 110.02 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -165.56 0.08 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.056 -1.027 . . . . 0.0 110.516 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.423 HD21 ' OG1' ' A' ' 91' ' ' THR . 15.9 tp -114.72 37.64 3.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.139 -0.975 . . . . 0.0 110.508 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -152.96 36.74 0.49 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.067 -1.021 . . . . 0.0 110.8 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -125.35 38.81 4.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.119 -0.988 . . . . 0.0 109.776 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -147.82 153.67 39.48 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.213 -0.93 . . . . 0.0 110.109 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -89.95 97.67 11.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.116 -0.99 . . . . 0.0 110.065 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.19 -35.25 0.84 Allowed Glycine 0 N--CA 1.495 2.63 0 C-N-CA 119.724 -1.227 . . . . 0.0 110.963 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.448 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 27.2 p-90 -52.09 -30.66 27.07 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.006 1.403 . . . . 0.0 111.062 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.448 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.6 tm-20 -60.0 -42.98 95.46 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 120.907 -1.121 . . . . 0.0 109.684 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.31 -39.46 90.58 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.172 -0.955 . . . . 0.0 109.816 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.6 mp -49.93 173.72 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.855 0 O-C-N 121.17 -0.956 . . . . 0.0 110.759 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -107.13 161.85 14.39 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.178 -0.951 . . . . 0.0 110.388 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.19 -43.9 74.82 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.132 -0.98 . . . . 0.0 110.481 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -62.43 -51.15 68.67 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.262 -0.899 . . . . 0.0 109.43 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.446 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 0.6 OUTLIER -62.19 -38.88 90.8 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.297 -0.877 . . . . 0.0 109.331 179.031 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -59.43 -39.19 82.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.233 -0.917 . . . . 0.0 109.775 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -59.99 -40.0 87.64 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.715 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.12 -38.94 92.86 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.219 -0.926 . . . . 0.0 110.019 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.465 HG22 HD11 ' A' ' 90' ' ' ILE . 45.9 mm -68.45 -41.51 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.152 -0.967 . . . . 0.0 109.026 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.423 ' OG1' HD21 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -60.55 -38.17 83.62 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.23 -0.919 . . . . 0.0 109.935 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -58.93 -40.23 83.97 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.149 -0.97 . . . . 0.0 109.991 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.518 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.3 m-70 -59.93 -47.61 85.08 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.206 -0.934 . . . . 0.0 109.933 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.418 HG13 ' CE1' ' A' ' 57' ' ' PHE . 19.4 mt -63.67 -39.25 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.202 -0.936 . . . . 0.0 109.61 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.03 95.83 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.216 -0.927 . . . . 0.0 109.438 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.24 -40.44 67.71 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.229 -0.919 . . . . 0.0 109.088 178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.1 tp -68.45 -33.12 73.62 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.196 -0.94 . . . . 0.0 110.228 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.7 t -93.96 -58.81 2.13 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.945 -1.097 . . . . 0.0 110.007 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.501 2.115 0 O-C-N 121.04 -1.037 . . . . 0.0 110.89 179.804 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -119.82 138.44 53.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.264 -0.898 . . . . 0.0 110.205 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.424 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 1.9 m-85 -118.21 150.06 40.04 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.219 -0.925 . . . . 0.0 110.284 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.9 m -134.15 156.39 48.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.262 -0.899 . . . . 0.0 110.032 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 52.6 t -109.82 135.54 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.118 -0.989 . . . . 0.0 110.028 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -148.35 153.58 38.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.185 -0.947 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -110.87 148.44 32.42 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.41 -0.807 . . . . 0.0 109.549 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.29 130.92 41.91 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.514 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -138.05 -65.68 0.51 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.171 -0.956 . . . . 0.0 110.432 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -116.98 110.87 18.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.214 -0.929 . . . . 0.0 110.318 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.18 142.34 10.49 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 m -116.26 135.88 53.5 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.205 -1.174 . . . . 0.0 110.048 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.28 144.51 31.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.182 -0.949 . . . . 0.0 110.51 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.7 156.34 53.35 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.83 143.86 26.08 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.211 -1.17 . . . . 0.0 108.726 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CB ' ' CE2' ' A' ' 51' ' ' TYR . 4.3 mmtt -52.91 147.32 9.32 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 120.86 -1.15 . . . . 0.0 110.311 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt 53.28 62.01 2.87 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.137 -0.977 . . . . 0.0 110.242 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.3 t -172.49 148.7 2.04 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.917 -1.114 . . . . 0.0 111.913 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -107.45 45.99 0.97 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -132.51 -171.84 2.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.591 -0.693 . . . . 0.0 109.956 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -135.3 153.09 51.99 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.026 -1.047 . . . . 0.0 110.535 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 72.0 mt -107.01 112.88 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.371 -0.83 . . . . 0.0 109.6 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.4 p -111.11 161.19 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.195 -0.941 . . . . 0.0 110.609 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.6 ptpp? -46.22 120.24 2.7 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 121.437 -0.79 . . . . 0.0 111.282 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 125.22 -22.0 6.37 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.999 -1.096 . . . . 0.0 111.004 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.9 m -100.69 138.21 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 CA-C-N 119.342 1.571 . . . . 0.0 110.52 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 42.4 t -82.66 141.96 32.08 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.233 -0.917 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.43 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 3.5 ptt85 -138.19 150.41 46.73 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.325 -0.859 . . . . 0.0 110.174 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.1 mt -105.62 144.25 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.293 -0.879 . . . . 0.0 109.98 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.89 132.13 10.99 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.424 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 27.5 ttpt -116.36 115.33 25.69 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.095 -1.238 . . . . 0.0 110.066 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.0 t -102.12 111.13 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.158 -0.964 . . . . 0.0 110.436 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.8 p -122.51 143.4 39.63 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.195 -0.94 . . . . 0.0 110.257 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -78.38 150.03 24.99 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 O-C-N 123.123 1.065 . . . . 0.0 110.634 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 N--CA 1.5 2.044 0 O-C-N 121.306 -0.872 . . . . 0.0 110.108 179.652 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.734 0 N-CA-C 109.824 -1.311 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -114.57 152.71 31.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.192 -1.181 . . . . 0.0 110.037 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.0 mmt -112.56 124.97 53.73 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.276 -0.89 . . . . 0.0 110.35 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -117.7 122.27 43.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.213 -0.929 . . . . 0.0 110.147 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -127.44 152.21 47.83 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.194 -0.942 . . . . 0.0 109.85 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.43 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 72.1 m95 -98.83 141.93 30.99 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.234 -0.916 . . . . 0.0 110.081 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CE2' ' CB ' ' A' ' 19' ' ' LYS . 96.0 m-85 -120.73 174.25 6.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.304 -0.873 . . . . 0.0 110.465 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -95.24 -173.12 2.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.502 HG23 ' NE2' ' A' ' 93' ' ' HIS . 40.9 mm -87.16 -37.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.051 -1.031 . . . . 0.0 109.263 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -88.99 -27.95 20.54 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.887 -1.133 . . . . 0.0 110.821 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 65.7 m -71.58 -49.15 43.14 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.966 -1.084 . . . . 0.0 109.911 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.35 -37.34 83.09 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.36 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.422 ' CE1' HG13 ' A' ' 94' ' ' ILE . 5.9 m-85 -74.33 -32.8 62.96 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 118.952 -1.099 . . . . 0.0 109.588 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -63.37 -36.74 84.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.49 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -59.9 -40.02 87.35 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.135 -0.978 . . . . 0.0 109.779 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -58.11 -45.28 87.52 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.179 -0.95 . . . . 0.0 109.262 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -59.56 -36.07 75.47 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 119.574 -0.851 . . . . 0.0 109.407 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -108.61 32.3 4.96 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.311 -0.868 . . . . 0.0 110.368 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.884 0 O-C-N 120.909 -1.119 . . . . 0.0 110.22 -179.966 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.1 mttt . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.2 mt 55.18 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.202 -0.936 . . . . 0.0 110.791 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -108.91 141.45 40.96 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.197 -0.94 . . . . 0.0 109.961 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 53.17 -173.06 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.987 -1.071 . . . . 0.0 110.677 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.444 ' CD2' ' OG1' ' A' ' 91' ' ' THR . 14.1 tp -98.39 -35.53 10.26 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.178 -0.951 . . . . 0.0 111.102 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -102.8 50.23 0.82 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.918 -1.114 . . . . 0.0 110.446 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -125.5 38.17 4.22 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.196 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.417 ' O ' ' CD1' ' A' ' 79' ' ' TRP . 48.4 mt -145.48 155.2 42.96 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.216 -0.927 . . . . 0.0 110.135 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -84.46 97.69 9.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.055 -1.028 . . . . 0.0 110.277 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.72 -37.32 0.62 Allowed Glycine 0 N--CA 1.497 2.736 0 C-N-CA 119.689 -1.243 . . . . 0.0 111.036 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.451 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 34.8 p-90 -55.22 -33.3 62.96 Favored 'General case' 0 N--CA 1.513 2.717 0 O-C-N 120.872 -1.369 . . . . 0.0 110.728 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.451 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.2 tt0 -54.18 -39.48 66.65 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.91 -1.119 . . . . 0.0 110.243 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -72.25 -36.43 69.07 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.212 -0.93 . . . . 0.0 110.02 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.416 HD13 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -53.25 -179.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.793 0 O-C-N 121.104 -0.998 . . . . 0.0 110.343 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -106.76 161.07 14.99 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.12 -0.987 . . . . 0.0 110.33 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.41 -39.94 81.12 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.391 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -66.23 -42.3 88.83 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.585 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -66.73 -39.89 88.16 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.539 -0.864 . . . . 0.0 109.359 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -60.54 -38.38 84.29 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.265 -0.897 . . . . 0.0 109.9 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.02 -40.36 84.74 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.879 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.44 -40.19 96.49 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.0 mt -65.38 -40.79 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.235 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.444 ' OG1' ' CD2' ' A' ' 73' ' ' LEU . 0.9 OUTLIER -59.22 -38.76 80.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.177 -0.952 . . . . 0.0 109.958 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -39.94 80.52 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.283 -0.886 . . . . 0.0 109.897 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.502 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.5 m-70 -58.35 -47.39 83.93 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.135 -0.978 . . . . 0.0 109.846 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.422 HG13 ' CE1' ' A' ' 57' ' ' PHE . 26.0 mt -66.12 -38.23 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.241 -0.912 . . . . 0.0 109.511 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.43 81.1 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.127 -0.983 . . . . 0.0 109.386 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.46 -41.89 68.84 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.217 -0.927 . . . . 0.0 108.836 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.5 tp -71.0 -33.64 70.6 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.345 -0.847 . . . . 0.0 109.815 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 41.3 m -100.67 46.73 0.94 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.968 -1.082 . . . . 0.0 110.075 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.174 -0.954 . . . . 0.0 110.368 179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 . . . . . 0 N--CA 1.495 1.782 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.06 121.65 32.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.197 -0.939 . . . . 0.0 110.308 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.413 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -112.5 144.49 41.87 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.171 -0.955 . . . . 0.0 109.722 179.687 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.7 p -135.65 164.62 27.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.899 . . . . 0.0 110.177 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 34.1 m -125.26 140.77 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.173 -0.955 . . . . 0.0 110.955 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -146.78 97.4 2.9 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.146 -0.971 . . . . 0.0 110.163 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.43 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 7.3 m-85 -54.06 154.61 4.09 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.188 -0.945 . . . . 0.0 110.456 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -108.32 131.21 54.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.279 -0.888 . . . . 0.0 110.696 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -117.09 -57.81 2.12 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.242 -0.911 . . . . 0.0 109.912 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.7 mtm-85 -119.12 159.43 23.97 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.242 -0.912 . . . . 0.0 110.02 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.64 162.42 29.59 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.5 m -133.86 144.21 48.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.144 -1.21 . . . . 0.0 110.322 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -135.77 143.42 45.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.737 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -74.37 123.51 7.78 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 11.0 t -62.35 130.61 46.05 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.272 -1.134 . . . . 0.0 109.412 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -61.89 147.8 45.54 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.173 -0.954 . . . . 0.0 109.209 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? 52.87 46.88 25.87 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.994 -1.066 . . . . 0.0 109.567 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.2 t -165.59 153.93 11.36 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.343 -0.848 . . . . 0.0 110.944 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -105.38 44.66 1.02 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -138.7 -175.03 4.0 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.464 -0.772 . . . . 0.0 109.978 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.56 157.24 46.18 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.203 -0.935 . . . . 0.0 110.06 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.416 HG12 ' CD2' ' A' ' 52' ' ' HIS . 59.7 mt -112.61 123.28 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.395 -0.816 . . . . 0.0 109.956 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.9 p -165.45 112.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.112 -0.992 . . . . 0.0 111.364 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.47 126.76 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.198 -0.939 . . . . 0.0 111.632 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.48 9.34 81.77 Favored Glycine 0 N--CA 1.496 2.652 0 O-C-N 121.077 -1.014 . . . . 0.0 111.808 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 95.1 t -126.66 135.59 63.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.708 1.754 . . . . 0.0 110.085 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.78 134.91 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.179 -0.95 . . . . 0.0 109.24 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 25.3 mtm180 -113.6 129.3 56.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.127 -0.983 . . . . 0.0 110.771 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.2 mt -103.81 128.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.215 -0.928 . . . . 0.0 108.515 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.9 130.52 10.27 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 21.0 tttm -107.03 113.53 27.06 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.334 -1.098 . . . . 0.0 109.393 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.7 t -96.72 112.76 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.142 -0.973 . . . . 0.0 110.538 -179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.1 t -120.77 111.03 34.69 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -73.39 127.35 11.77 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.205 1.108 . . . . 0.0 110.427 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 m120 . . . . . 0 N--CA 1.499 1.99 0 O-C-N 121.179 -0.95 . . . . 0.0 110.084 179.78 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.54 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -134.58 138.87 44.94 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.235 -1.156 . . . . 0.0 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.2 mtp -117.02 149.58 40.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.173 -0.954 . . . . 0.0 110.233 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -129.46 144.91 51.45 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.32 -0.862 . . . . 0.0 110.534 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -122.76 148.06 45.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.147 -0.971 . . . . 0.0 109.581 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -93.99 151.07 19.8 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.104 -0.997 . . . . 0.0 110.133 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -135.03 173.22 11.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.279 -0.888 . . . . 0.0 110.414 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.416 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -96.03 -172.34 2.54 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.876 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.498 HG23 ' NE2' ' A' ' 93' ' ' HIS . 43.6 mm -84.38 -39.85 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 121.09 -1.006 . . . . 0.0 108.777 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -89.02 -25.68 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.922 -1.111 . . . . 0.0 111.081 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.7 m -75.95 -42.2 49.31 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.78 -1.2 . . . . 0.0 109.987 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -38.18 66.62 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.86 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.431 ' CE1' HG13 ' A' ' 94' ' ' ILE . 6.9 m-85 -73.6 -31.82 63.78 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 119.029 -1.068 . . . . 0.0 109.553 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -63.91 -38.24 90.37 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.052 -1.03 . . . . 0.0 109.337 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -41.17 97.7 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.515 179.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.99 -46.02 90.84 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.287 -0.883 . . . . 0.0 109.302 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -56.35 -33.73 65.95 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.765 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 24.7 mtp-105 -105.85 30.24 5.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.174 -0.953 . . . . 0.0 110.627 179.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.948 0 O-C-N 120.906 -1.121 . . . . 0.0 109.97 179.687 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 120.706 0.289 . . . . 0.0 110.256 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.3 mt 54.41 98.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.126 -0.984 . . . . 0.0 110.661 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -114.2 138.06 50.96 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.183 -0.948 . . . . 0.0 110.069 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.33 -166.01 0.07 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.061 -1.024 . . . . 0.0 110.596 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.447 ' CD2' ' OG1' ' A' ' 91' ' ' THR . 4.5 tp -115.63 39.54 2.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.176 -0.953 . . . . 0.0 110.374 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.4 HG21 ' CZ2' ' A' ' 79' ' ' TRP . 2.9 p -149.28 38.04 0.78 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.577 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -137.02 37.08 2.57 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.23 -0.919 . . . . 0.0 110.247 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -122.09 152.25 40.04 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.113 -0.992 . . . . 0.0 109.906 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.35 106.76 0.8 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.312 -0.868 . . . . 0.0 111.359 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 65.81 59.31 7.73 Favored Glycine 0 N--CA 1.492 2.423 0 O-C-N 121.247 -0.908 . . . . 0.0 111.161 178.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.474 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 34.9 p-90 -88.94 -38.19 14.67 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.967 -1.314 . . . . 0.0 109.952 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.474 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 8.5 tm-20 -69.2 -40.74 77.87 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.164 -0.96 . . . . 0.0 109.082 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.24 -28.02 50.36 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.199 -0.938 . . . . 0.0 111.144 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.43 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 95.6 mt -69.81 -175.06 0.83 Allowed 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.624 -1.297 . . . . 0.0 109.762 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -62.76 155.25 27.18 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.168 -0.957 . . . . 0.0 110.06 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -87.88 -41.07 13.46 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.241 -0.912 . . . . 0.0 110.192 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -65.66 -43.99 87.7 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.28 -0.887 . . . . 0.0 109.56 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 47.8 mt-10 -64.63 -39.47 93.76 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.332 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.7 tptt -58.52 -39.16 79.34 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.257 -0.902 . . . . 0.0 109.76 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.7 -37.93 74.33 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.242 -0.911 . . . . 0.0 109.969 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -59.24 -39.22 82.08 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.232 -0.917 . . . . 0.0 110.062 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 70.2 mt -64.53 -41.05 91.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 O-C-N 121.169 -0.957 . . . . 0.0 109.058 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.447 ' OG1' ' CD2' ' A' ' 73' ' ' LEU . 2.0 m -57.08 -38.45 73.34 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.179 -0.95 . . . . 0.0 109.966 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.11 -40.35 80.99 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.223 -0.923 . . . . 0.0 109.8 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.498 ' NE2' HG23 ' A' ' 53' ' ' ILE . 2.1 m-70 -60.39 -50.59 72.98 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.163 -0.961 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.431 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.0 mt -62.5 -39.44 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 109.471 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.67 -41.31 96.18 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.218 -0.926 . . . . 0.0 109.272 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.53 -40.99 69.71 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.028 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.9 tp -69.64 -33.85 73.2 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.282 -0.886 . . . . 0.0 110.073 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 18.2 t -96.44 -65.5 0.96 Allowed 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.1 t . . . . . 0 N--CA 1.501 2.081 0 O-C-N 121.079 -1.013 . . . . 0.0 110.792 -179.971 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 120.898 0.38 . . . . 0.0 110.814 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -128.13 137.48 52.13 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.134 -0.978 . . . . 0.0 110.271 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.422 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 1.5 m-85 -115.98 137.65 51.92 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.136 -0.978 . . . . 0.0 110.162 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -122.25 164.93 17.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.25 -0.906 . . . . 0.0 109.308 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 32.7 m -134.97 134.3 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.926 -1.109 . . . . 0.0 110.815 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -139.93 147.63 40.81 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.211 -0.93 . . . . 0.0 109.876 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.431 ' OH ' HD13 ' A' ' 90' ' ' ILE . 1.7 m-85 -101.44 148.03 25.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.239 -0.913 . . . . 0.0 109.985 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -108.09 144.87 34.87 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.289 -0.882 . . . . 0.0 110.557 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -115.17 -56.4 2.37 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.224 -0.923 . . . . 0.0 110.122 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 mtt85 -141.39 72.95 1.4 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.48 -176.2 15.61 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 34.9 m -140.22 116.16 10.35 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.154 -1.204 . . . . 0.0 110.235 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.19 133.3 24.36 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.163 -0.96 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -76.62 123.33 6.66 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.2 t -61.4 127.78 33.14 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.266 -1.138 . . . . 0.0 109.483 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -61.51 147.94 43.69 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.188 -0.945 . . . . 0.0 109.201 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 54.21 44.24 29.4 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.872 -1.142 . . . . 0.0 109.468 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.4 t -165.87 149.65 7.92 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.374 -0.829 . . . . 0.0 110.692 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 tttt -101.09 51.27 0.85 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 0.0 108.678 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.16 -174.99 4.44 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.453 -0.78 . . . . 0.0 110.339 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -133.67 161.05 35.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.184 -0.947 . . . . 0.0 109.759 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.7 mt -111.28 110.86 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.408 -0.808 . . . . 0.0 109.775 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.5 t -141.04 103.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.134 -0.978 . . . . 0.0 111.455 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.8 tttp 59.91 142.4 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.204 -0.935 . . . . 0.0 112.171 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.94 12.64 65.31 Favored Glycine 0 N--CA 1.497 2.754 0 O-C-N 121.088 -1.008 . . . . 0.0 111.841 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 84.0 t -128.77 136.65 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 CA-C-N 119.786 1.793 . . . . 0.0 110.486 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 3.0 t -94.57 131.55 40.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.284 -0.885 . . . . 0.0 108.788 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -106.52 129.31 54.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.149 -0.969 . . . . 0.0 110.719 -179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.2 mt -104.31 127.11 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.91 126.97 9.07 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.422 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.7 ttpm? -103.44 107.83 18.83 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.365 -1.079 . . . . 0.0 109.331 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -102.03 107.86 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.161 -0.962 . . . . 0.0 110.605 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 34.4 m -123.57 146.22 49.4 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.282 -0.886 . . . . 0.0 109.778 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -76.04 135.62 17.42 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.224 1.118 . . . . 0.0 110.353 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 . . . . . 0 N--CA 1.5 2.036 0 O-C-N 121.182 -0.949 . . . . 0.0 109.886 179.7 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.473 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -134.32 142.21 47.18 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.239 -1.153 . . . . 0.0 110.039 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 34.8 mtp -117.71 137.09 52.92 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.117 -0.989 . . . . 0.0 110.618 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -131.56 129.11 40.56 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.218 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -132.84 155.01 49.76 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.206 -0.934 . . . . 0.0 109.888 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -98.49 163.37 12.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.115 -0.99 . . . . 0.0 110.006 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -145.71 172.37 13.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.227 -0.92 . . . . 0.0 110.596 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 -172.27 2.68 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.504 HG23 ' NE2' ' A' ' 93' ' ' HIS . 45.2 mm -86.72 -40.07 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.088 0 O-C-N 121.021 -1.049 . . . . 0.0 108.999 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -89.32 -24.47 22.0 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 120.864 -1.148 . . . . 0.0 111.012 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.4 m -75.17 -44.87 44.3 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.734 -1.229 . . . . 0.0 110.01 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -37.66 69.3 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.919 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.427 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 8.0 m-85 -74.08 -31.8 62.98 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.417 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.08 -37.75 88.44 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.002 -1.061 . . . . 0.0 109.531 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.0 tttp -58.71 -39.56 81.14 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.117 -0.989 . . . . 0.0 109.849 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.3 mp -59.35 -43.33 92.81 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.264 -0.898 . . . . 0.0 109.299 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -36.16 74.95 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.282 -0.886 . . . . 0.0 109.513 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.3 mmt-85 -105.86 31.28 5.15 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.241 -0.912 . . . . 0.0 110.561 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.854 0 O-C-N 120.907 -1.121 . . . . 0.0 110.109 179.86 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 22.9 mtmm . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 120.775 0.321 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.4 mt 53.78 97.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.091 -1.006 . . . . 0.0 110.809 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -113.32 133.76 54.96 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.197 -0.939 . . . . 0.0 109.692 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 53.08 -170.54 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.958 -1.089 . . . . 0.0 110.333 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -108.39 -58.58 1.98 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.081 -1.012 . . . . 0.0 110.051 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -33.74 70.16 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.166 -0.959 . . . . 0.0 110.544 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -49.07 -33.78 12.26 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 120.989 -1.07 . . . . 0.0 111.462 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 54.7 mt -82.65 152.38 25.88 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.008 -1.058 . . . . 0.0 109.994 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -92.75 136.58 33.11 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.266 -0.896 . . . . 0.0 110.572 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 136.75 -47.49 0.96 Allowed Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.444 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 54.7 p-90 -50.48 -30.24 12.3 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.15 -1.206 . . . . 0.0 111.449 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.444 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 6.4 tm-20 -52.52 -28.85 22.29 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.883 -1.136 . . . . 0.0 111.28 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -113.06 29.31 8.08 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.95 -1.094 . . . . 0.0 111.788 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 33.3 mt -113.28 -165.85 1.03 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.854 -1.154 . . . . 0.0 109.799 179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -100.78 162.21 13.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.049 -1.032 . . . . 0.0 110.068 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -79.12 -39.77 32.77 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.202 -0.936 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -69.19 -41.42 77.16 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.159 -0.963 . . . . 0.0 109.501 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -39.15 73.05 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.918 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -61.11 -39.23 89.2 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.171 -0.955 . . . . 0.0 109.531 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -56.93 -34.9 68.43 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.141 -0.974 . . . . 0.0 110.212 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -58.12 -39.41 78.63 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.16 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.431 HD13 ' OH ' ' A' ' 10' ' ' TYR . 10.9 mt -66.29 -40.88 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.401 0 O-C-N 121.176 -0.953 . . . . 0.0 109.219 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.1 m -58.9 -37.89 77.65 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.256 -0.903 . . . . 0.0 110.0 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -58.9 -40.47 84.58 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.154 -0.966 . . . . 0.0 109.822 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.504 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.7 m-70 -60.38 -49.66 76.7 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.155 -0.966 . . . . 0.0 109.75 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.427 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.9 mt -63.79 -39.4 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.215 -0.928 . . . . 0.0 109.565 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.18 -40.7 98.27 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.142 -0.974 . . . . 0.0 109.341 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -71.86 -38.3 70.08 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.261 -0.9 . . . . 0.0 109.226 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.0 tp -72.95 -37.34 67.16 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.271 -0.893 . . . . 0.0 109.951 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 m -65.28 -51.47 60.57 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.098 -1.001 . . . . 0.0 109.991 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.74 0 O-C-N 121.173 -0.955 . . . . 0.0 110.305 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 . . . . . 0 N--CA 1.495 1.792 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -124.51 131.61 53.49 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.266 -0.896 . . . . 0.0 110.185 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.5 m-85 -125.15 136.76 53.93 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.153 -0.967 . . . . 0.0 110.275 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -121.89 164.12 18.09 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.243 -0.91 . . . . 0.0 109.062 179.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 25.4 m -130.95 134.98 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.945 -1.097 . . . . 0.0 110.465 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -139.67 156.69 46.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.151 -0.968 . . . . 0.0 110.2 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.424 ' CZ ' ' HB3' ' A' ' 86' ' ' GLU . 0.5 OUTLIER -105.97 156.15 18.66 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.366 -0.834 . . . . 0.0 110.069 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.05 102.67 12.71 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.261 -0.899 . . . . 0.0 110.503 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -115.13 -56.21 2.39 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.303 -0.873 . . . . 0.0 109.94 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -114.91 83.19 1.86 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.202 -0.936 . . . . 0.0 110.029 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 142.08 170.47 12.57 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -143.91 140.84 29.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.175 -1.191 . . . . 0.0 110.531 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.03 147.38 51.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.249 -0.907 . . . . 0.0 110.471 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.43 122.05 5.83 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.1 t -64.49 124.54 22.1 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.177 -1.19 . . . . 0.0 109.447 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 148.54 40.32 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.999 -1.063 . . . . 0.0 108.939 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 mttm 52.85 64.1 1.99 Allowed 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.982 -1.074 . . . . 0.0 108.984 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.5 t -172.98 -44.45 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.264 -0.897 . . . . 0.0 112.54 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt 70.08 44.15 0.81 Allowed 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.935 -1.103 . . . . 0.0 108.341 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -141.05 -170.05 2.96 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.539 -0.726 . . . . 0.0 109.364 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -127.6 156.02 42.93 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.883 -1.135 . . . . 0.0 110.92 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.425 HG12 ' CD2' ' A' ' 52' ' ' HIS . 15.8 mt -120.09 104.2 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -0.757 . . . . 0.0 109.615 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.1 p -163.84 147.59 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.084 -1.01 . . . . 0.0 111.578 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt 53.94 102.82 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.381 -0.824 . . . . 0.0 111.664 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.22 11.28 85.05 Favored Glycine 0 N--CA 1.494 2.549 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.012 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.402 ' CG1' ' CG2' ' A' ' 25' ' ' ILE . 93.1 t -121.78 135.2 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 CA-C-N 119.87 1.835 . . . . 0.0 110.634 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.7 t -105.75 141.19 37.61 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.26 -0.9 . . . . 0.0 108.829 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.2 ptp180 -122.21 144.66 48.83 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.154 -0.966 . . . . 0.0 111.408 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.6 mt -107.16 137.51 37.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.339 -0.851 . . . . 0.0 109.412 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.446 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.32 128.2 9.39 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.164 -1.575 . . . . 0.0 109.164 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.419 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 30.0 tttt -112.23 117.53 32.79 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.192 -1.181 . . . . 0.0 109.973 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.8 t -100.55 109.04 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.072 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.3 t -120.79 124.38 27.54 Favored Pre-proline 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 109.773 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.85 142.58 35.47 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 O-C-N 123.146 1.077 . . . . 0.0 110.452 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 N--CA 1.499 2.003 0 O-C-N 121.16 -0.963 . . . . 0.0 110.216 179.777 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.609 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -146.09 135.11 22.63 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.16 -1.2 . . . . 0.0 110.351 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.5 mtp -117.62 141.52 48.28 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.194 -0.941 . . . . 0.0 110.366 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -130.42 127.71 39.86 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.132 -0.98 . . . . 0.0 110.25 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.92 153.57 42.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.122 -0.986 . . . . 0.0 110.088 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 56.6 m95 -105.98 129.6 54.07 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.194 -0.941 . . . . 0.0 109.949 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -112.41 177.11 4.75 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.21 -0.931 . . . . 0.0 111.162 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.425 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -94.69 -170.68 2.29 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.519 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.454 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 46.3 mm -88.3 -43.6 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.044 -1.035 . . . . 0.0 108.982 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -21.95 27.27 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.993 -1.067 . . . . 0.0 111.399 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 63.0 m -75.38 -43.68 48.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.683 -1.261 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.2 tpt -73.59 -39.33 64.7 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.733 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.496 ' CD2' ' CD2' ' A' ' 93' ' ' HIS . 10.1 m-85 -73.32 -30.21 63.21 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.967 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.42 -36.83 82.03 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.927 -1.108 . . . . 0.0 109.403 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -58.5 -38.64 78.09 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.991 -1.068 . . . . 0.0 109.888 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.2 -41.33 86.0 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.746 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -67.01 -33.58 75.87 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.3 -0.875 . . . . 0.0 110.647 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 18.2 ttt85 -86.5 -35.88 19.34 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.12 -0.988 . . . . 0.0 110.42 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.83 0 O-C-N 121.045 -1.034 . . . . 0.0 110.061 179.873 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt . . . . . 0 N--CA 1.493 1.708 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.411 HD11 HG22 ' A' ' 70' ' ' ILE . 77.5 mt 52.84 94.71 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.048 -1.033 . . . . 0.0 110.589 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -115.22 135.4 54.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.966 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 53.46 -165.25 0.08 Allowed 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.1 -1.0 . . . . 0.0 110.542 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 tt -103.68 -48.12 4.04 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.171 -0.955 . . . . 0.0 110.354 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.31 69.62 4.54 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.125 -0.985 . . . . 0.0 109.817 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -143.49 -58.6 0.41 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.267 -0.896 . . . . 0.0 110.07 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.3 mt -62.52 151.59 37.12 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.163 -0.961 . . . . 0.0 109.564 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -79.94 128.84 33.95 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.184 -0.948 . . . . 0.0 110.262 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 143.71 -47.62 0.78 Allowed Glycine 0 N--CA 1.494 2.505 0 C-N-CA 119.753 -1.213 . . . . 0.0 110.588 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.447 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 45.9 p-90 -51.7 -30.54 22.51 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.917 -1.343 . . . . 0.0 111.216 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 5.8 tp10 -53.76 -27.91 31.45 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.963 -1.086 . . . . 0.0 111.332 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -111.74 26.95 10.11 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.821 -1.174 . . . . 0.0 112.064 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.409 HD12 ' CD2' ' A' ' 10' ' ' TYR . 29.9 mt -108.81 -164.27 0.93 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.812 -1.18 . . . . 0.0 109.555 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -94.98 161.89 13.96 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.957 -1.09 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -76.36 -47.9 21.79 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.238 -0.914 . . . . 0.0 109.999 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.3 -41.65 93.88 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.236 -0.915 . . . . 0.0 109.594 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.424 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 15.3 mt-10 -59.46 -39.98 85.4 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.291 -0.881 . . . . 0.0 109.628 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.6 ttpp -56.39 -39.23 72.63 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.207 -0.933 . . . . 0.0 109.97 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -57.88 -37.92 74.82 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.263 -0.898 . . . . 0.0 109.961 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -70.07 -33.72 72.28 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.122 -0.986 . . . . 0.0 110.031 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.9 mt -70.37 -38.64 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.11 -0.994 . . . . 0.0 110.003 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.402 HG21 ' N ' ' A' ' 92' ' ' GLN . 9.5 t -69.04 -32.42 71.9 Favored 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 118.913 -1.115 . . . . 0.0 110.276 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . 0.402 ' N ' HG21 ' A' ' 91' ' ' THR . 0.4 OUTLIER -71.58 -39.89 70.29 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.992 -1.067 . . . . 0.0 108.781 178.443 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.496 ' CD2' ' CD2' ' A' ' 57' ' ' PHE . 70.0 t60 -56.27 -43.79 79.12 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.268 -0.895 . . . . 0.0 109.721 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.439 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 58.0 mt -67.94 -39.68 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.905 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.43 85.12 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.16 -0.963 . . . . 0.0 109.681 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.35 -42.29 95.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.16 -0.963 . . . . 0.0 109.377 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 tp -66.07 -35.86 81.65 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.297 -0.877 . . . . 0.0 109.859 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 73.6 m -105.09 58.6 0.68 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.156 -0.965 . . . . 0.0 109.971 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.091 -1.006 . . . . 0.0 110.283 -179.934 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 . . . . . 0 N--CA 1.496 1.847 0 CA-C-O 120.655 0.264 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -139.69 131.85 28.09 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.235 -0.916 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.42 ' CE2' ' HG3' ' A' ' 34' ' ' LYS . 1.1 m-85 -125.4 139.95 53.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.166 -0.959 . . . . 0.0 110.25 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.5 m -127.39 163.19 24.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.921 . . . . 0.0 108.871 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.403 ' CG2' ' N ' ' A' ' 79' ' ' TRP . 29.2 m -133.76 133.29 56.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.95 -1.094 . . . . 0.0 110.753 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -139.3 155.28 47.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.307 -0.871 . . . . 0.0 109.989 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.413 ' CE2' HD22 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -102.11 143.15 32.29 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.31 -0.869 . . . . 0.0 109.884 179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.31 138.38 56.47 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.156 -0.965 . . . . 0.0 110.146 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mttt -130.05 -59.8 1.04 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 110.334 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.01 93.31 2.38 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.199 -0.938 . . . . 0.0 110.422 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.9 142.97 4.23 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.8 p -114.69 147.01 40.24 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.259 -1.142 . . . . 0.0 109.921 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.62 147.79 38.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.089 -1.007 . . . . 0.0 111.003 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.94 124.88 18.23 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.1 t -61.36 131.05 49.03 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.221 -1.164 . . . . 0.0 109.344 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm -62.22 148.17 45.57 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.156 -0.965 . . . . 0.0 109.269 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttt 52.45 47.42 24.75 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.972 -1.08 . . . . 0.0 109.673 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.3 t -164.8 153.03 12.06 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.31 -0.869 . . . . 0.0 110.895 -178.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 tttm -103.84 46.96 0.89 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -142.05 -174.37 4.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.404 -0.81 . . . . 0.0 110.197 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -133.2 156.27 47.82 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.222 -0.924 . . . . 0.0 109.727 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.435 HD11 HG22 ' A' ' 25' ' ' ILE . 62.2 mt -96.35 113.04 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.81 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 67.9 t -108.51 162.78 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -41.44 133.15 2.59 Favored 'General case' 0 N--CA 1.519 3.02 0 O-C-N 121.689 -0.632 . . . . 0.0 111.527 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.8 4.31 45.61 Favored Glycine 0 N--CA 1.493 2.453 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.084 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.3 t -115.11 134.79 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-N 119.582 1.691 . . . . 0.0 109.546 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.9 t -85.39 134.41 34.08 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.169 -0.957 . . . . 0.0 108.933 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 46.1 mtm105 -115.43 135.48 54.07 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.177 -0.952 . . . . 0.0 111.275 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.9 mt -104.7 129.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.1 131.71 10.7 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.42 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 22.7 tttt -110.78 113.45 26.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.327 -1.102 . . . . 0.0 109.566 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.73 107.62 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.148 -0.97 . . . . 0.0 110.198 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.2 p -124.08 127.17 25.45 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.282 -0.886 . . . . 0.0 110.193 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.63 139.05 27.62 Favored 'Trans proline' 0 C--N 1.319 -0.983 0 O-C-N 123.088 1.046 . . . . 0.0 110.514 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.061 0 O-C-N 121.285 -0.885 . . . . 0.0 109.95 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.499 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -130.82 146.59 52.31 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.193 -1.18 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.2 ttm -115.66 149.08 38.93 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.191 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -129.23 148.75 51.2 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.552 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.47 155.28 48.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.57 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 71.0 m95 -98.13 156.87 16.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.122 -0.986 . . . . 0.0 110.157 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -136.15 172.99 12.2 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.317 -0.864 . . . . 0.0 110.546 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.72 -170.42 2.58 Favored 'General case' 0 N--CA 1.504 2.232 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.483 HG23 ' NE2' ' A' ' 93' ' ' HIS . 42.1 mm -83.89 -60.02 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.161 179.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' A' ' 93' ' ' HIS . 23.7 mmtt -73.82 -27.42 61.11 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.927 -1.108 . . . . 0.0 111.262 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 84.5 m -65.87 -51.47 58.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 120.741 -1.224 . . . . 0.0 110.253 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.406 ' CE ' ' CD1' ' A' ' 70' ' ' ILE . 0.6 OUTLIER -70.05 -39.55 75.65 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.814 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.434 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 8.6 m-85 -71.85 -28.56 63.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.2 -1.0 . . . . 0.0 109.944 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -67.38 -37.01 82.48 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.789 -1.194 . . . . 0.0 109.43 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -58.58 -40.49 83.29 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.023 -1.048 . . . . 0.0 109.755 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.22 -42.17 98.14 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.227 -0.921 . . . . 0.0 109.129 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -56.71 -33.83 66.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.152 -0.968 . . . . 0.0 109.67 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.8 mtt-85 -103.35 29.84 5.34 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.215 -0.928 . . . . 0.0 110.497 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.883 0 O-C-N 120.882 -1.136 . . . . 0.0 109.976 179.805 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 120.637 0.256 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.406 ' CD1' ' CE ' ' A' ' 56' ' ' MET . 83.4 mt 54.54 101.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.949 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -110.23 141.17 43.55 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.158 -0.964 . . . . 0.0 109.789 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.6 t0 53.41 -169.9 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.035 -1.041 . . . . 0.0 110.416 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.428 HD23 ' OG1' ' A' ' 91' ' ' THR . 18.7 tp -118.52 38.58 3.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.105 -0.997 . . . . 0.0 110.648 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 35.98 0.82 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.132 -0.98 . . . . 0.0 110.55 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -131.43 29.45 4.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.201 -0.937 . . . . 0.0 110.559 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.4 mt -137.46 153.57 50.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.045 -1.034 . . . . 0.0 109.401 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.8 102.24 11.47 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.07 -1.018 . . . . 0.0 110.393 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.93 -39.11 0.6 Allowed Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.674 -1.25 . . . . 0.0 111.105 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.403 ' N ' ' CG2' ' A' ' 8' ' ' VAL . 46.6 p-90 -57.26 -32.17 66.32 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.832 -1.393 . . . . 0.0 110.913 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -53.26 -34.27 56.5 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.832 -1.167 . . . . 0.0 110.612 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.86 -36.06 31.89 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.999 -1.063 . . . . 0.0 110.295 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.413 HD22 ' CE2' ' A' ' 10' ' ' TYR . 0.2 OUTLIER -51.02 176.91 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.965 -1.084 . . . . 0.0 110.66 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -104.02 160.4 14.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.078 -1.014 . . . . 0.0 110.406 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -60.44 -46.01 91.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.238 -0.914 . . . . 0.0 110.086 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -61.56 -48.04 82.79 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.553 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -64.66 -40.59 95.69 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.429 -0.909 . . . . 0.0 109.197 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.409 ' O ' ' OG1' ' A' ' 91' ' ' THR . 12.5 tttm -62.3 -38.9 91.17 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.347 -0.846 . . . . 0.0 109.911 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.07 -41.12 97.84 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.196 -0.94 . . . . 0.0 109.893 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -66.89 -38.04 85.53 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.244 -0.91 . . . . 0.0 110.081 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 90' ' ' ILE . 45.7 mm -67.14 -38.5 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.124 -0.985 . . . . 0.0 109.338 179.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.428 ' OG1' HD23 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -59.24 -39.03 81.47 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.135 -0.978 . . . . 0.0 109.811 179.472 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -56.02 -36.76 68.33 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.063 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.483 ' NE2' HG23 ' A' ' 53' ' ' ILE . 0.2 OUTLIER -58.82 -51.61 69.26 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.677 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.434 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.2 mt -60.79 -37.59 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.225 -0.922 . . . . 0.0 109.704 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.09 86.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.168 -0.957 . . . . 0.0 109.62 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.37 -43.35 77.56 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.232 -0.917 . . . . 0.0 108.791 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.73 -35.06 79.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.315 -0.865 . . . . 0.0 109.77 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.3 m -100.62 66.59 1.23 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.981 -1.074 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.126 -0.984 . . . . 0.0 110.177 179.997 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 . . . . . 0 N--CA 1.496 1.829 0 CA-C-O 120.723 0.296 . . . . 0.0 110.337 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.2 137.86 31.08 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.217 -0.927 . . . . 0.0 110.191 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.7 m-85 -117.25 142.13 47.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.9 m -130.51 165.0 23.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.262 -0.899 . . . . 0.0 109.314 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.8 m -130.64 139.83 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.066 -1.022 . . . . 0.0 110.641 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.02 107.66 4.12 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.239 -0.913 . . . . 0.0 110.35 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.423 ' CD2' HD12 ' A' ' 82' ' ' LEU . 10.5 m-85 -58.9 153.03 18.13 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.162 -0.961 . . . . 0.0 110.054 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.75 136.55 48.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.309 -0.869 . . . . 0.0 110.311 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -120.16 -57.34 1.94 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.253 -0.904 . . . . 0.0 110.306 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -128.24 122.99 33.06 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.097 -1.002 . . . . 0.0 110.161 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.98 170.88 11.96 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.422 ' OG1' HG13 ' A' ' 26' ' ' VAL . 57.4 m -140.98 135.44 31.17 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.18 -1.188 . . . . 0.0 110.126 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.44 137.17 26.8 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.16 -0.963 . . . . 0.0 110.734 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.6 123.21 15.73 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.6 t -62.37 130.9 47.39 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.246 -1.15 . . . . 0.0 109.46 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -62.41 147.33 48.89 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.117 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? 52.5 48.21 23.06 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.02 -1.05 . . . . 0.0 109.579 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -164.93 153.3 12.04 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.401 -0.812 . . . . 0.0 110.852 -178.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -104.05 46.27 0.92 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -143.28 -174.63 4.26 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.498 -0.751 . . . . 0.0 110.077 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -136.16 155.5 50.06 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.112 -0.993 . . . . 0.0 109.727 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.427 HG22 HD11 ' A' ' 25' ' ' ILE . 59.5 mt -103.86 118.29 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.303 -0.873 . . . . 0.0 109.709 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.422 HG13 ' OG1' ' A' ' 15' ' ' THR . 29.7 m -137.48 89.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.106 -0.996 . . . . 0.0 111.251 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 tttm 60.3 149.45 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.081 -1.012 . . . . 0.0 111.318 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.13 9.18 80.25 Favored Glycine 0 N--CA 1.496 2.678 0 C-N-CA 120.245 -0.978 . . . . 0.0 111.712 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 80.1 t -127.6 135.17 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-N 119.712 1.756 . . . . 0.0 110.247 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.7 t -87.47 120.96 29.3 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.6 mtm180 -101.69 129.8 47.93 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.939 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.9 mt -103.82 131.06 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.13 126.0 8.77 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 40.4 tttt -107.48 116.99 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.289 -1.124 . . . . 0.0 109.741 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.87 111.96 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.097 -1.002 . . . . 0.0 110.106 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 73.7 t -120.37 113.64 33.63 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.247 -0.908 . . . . 0.0 109.794 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.35 147.24 46.76 Favored 'Trans proline' 0 N--CA 1.485 1.018 0 O-C-N 123.202 1.106 . . . . 0.0 110.47 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.5 2.053 0 O-C-N 121.327 -0.858 . . . . 0.0 110.233 179.846 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.467 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -122.02 143.29 49.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.198 -1.177 . . . . 0.0 110.271 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -117.15 129.66 56.11 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.244 -0.91 . . . . 0.0 110.26 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -122.99 136.0 54.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -139.76 155.8 47.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.131 -0.981 . . . . 0.0 109.923 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 51.8 m95 -98.11 163.01 12.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.185 -0.947 . . . . 0.0 110.138 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -143.66 172.69 12.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.265 -0.897 . . . . 0.0 110.683 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -91.71 -172.07 3.09 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.517 HG23 ' NE2' ' A' ' 93' ' ' HIS . 44.6 mm -83.38 -47.1 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 C-N-CA 119.117 -1.033 . . . . 0.0 109.047 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.7 mtmt -80.22 -32.89 38.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.798 -1.189 . . . . 0.0 110.717 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.8 m -62.67 -50.92 69.28 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.939 -1.101 . . . . 0.0 110.235 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.0 tpt -68.0 -42.22 81.08 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.842 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.431 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 9.8 m-85 -69.27 -30.71 68.88 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.647 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.61 -37.82 85.36 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.962 -1.086 . . . . 0.0 109.417 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -58.18 -39.19 78.26 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.027 -1.046 . . . . 0.0 109.903 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.7 mp -58.1 -41.78 84.28 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.154 -0.966 . . . . 0.0 109.346 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -57.95 -34.12 69.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.236 -0.915 . . . . 0.0 109.589 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -104.4 30.46 5.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.196 -0.94 . . . . 0.0 110.525 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.021 0 O-C-N 120.892 -1.13 . . . . 0.0 110.071 179.786 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.4 mt 54.97 99.21 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 O-C-N 121.126 -0.984 . . . . 0.0 110.469 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -109.49 139.91 43.9 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.156 -0.965 . . . . 0.0 110.31 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.17 -176.73 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.092 -1.005 . . . . 0.0 110.896 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.459 ' CD2' ' OG1' ' A' ' 91' ' ' THR . 15.0 tp -98.73 -29.65 12.89 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.25 42.88 1.08 Allowed 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.779 -1.201 . . . . 0.0 110.404 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -122.06 34.7 5.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.142 -0.974 . . . . 0.0 110.192 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.4 ' O ' ' CD1' ' A' ' 79' ' ' TRP . 57.3 mt -145.8 153.71 41.22 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.05 -1.031 . . . . 0.0 109.963 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -85.13 116.37 23.46 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.046 -1.034 . . . . 0.0 110.442 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 148.49 -40.92 0.9 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.744 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.4 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 48.9 p-90 -61.93 -26.1 67.98 Favored 'General case' 0 N--CA 1.513 2.684 0 O-C-N 121.069 -1.253 . . . . 0.0 111.538 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -53.05 -28.04 22.75 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 120.788 -1.195 . . . . 0.0 111.465 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -112.77 28.45 8.78 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.809 -1.182 . . . . 0.0 112.116 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 10' ' ' TYR . 25.8 mt -109.76 -166.1 1.07 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.714 -1.242 . . . . 0.0 109.918 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -97.74 162.83 13.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.101 -0.999 . . . . 0.0 110.333 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -81.96 -39.89 23.02 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.212 -0.93 . . . . 0.0 110.306 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -61.85 -50.54 71.86 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.19 -0.944 . . . . 0.0 109.596 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.415 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 10.7 mt-10 -61.75 -41.49 97.73 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.289 -0.882 . . . . 0.0 109.227 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.17 -34.36 72.02 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.259 -0.901 . . . . 0.0 110.208 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.71 -35.3 76.99 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.053 -1.029 . . . . 0.0 110.236 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.04 -41.32 77.81 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.969 -1.082 . . . . 0.0 110.201 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.5 tt -65.04 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.223 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.459 ' OG1' ' CD2' ' A' ' 73' ' ' LEU . 0.3 OUTLIER -65.4 -40.01 92.92 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.846 -1.159 . . . . 0.0 109.317 178.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -35.33 63.56 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.277 -0.89 . . . . 0.0 110.247 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.517 ' NE2' HG23 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -56.8 -47.29 80.55 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 121.037 -1.04 . . . . 0.0 109.922 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.431 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 16.6 mt -63.63 -37.48 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.114 -0.991 . . . . 0.0 109.724 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.09 -39.56 95.08 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.144 -0.973 . . . . 0.0 109.664 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.13 -36.8 69.5 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.2 -0.937 . . . . 0.0 109.801 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.2 tp -79.76 -30.95 40.88 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.179 -0.951 . . . . 0.0 110.584 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 66.9 m -93.08 -38.14 11.78 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.835 -1.165 . . . . 0.0 110.349 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.497 1.904 0 O-C-N 121.127 -0.983 . . . . 0.0 110.157 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 . . . . . 0 N--CA 1.495 1.813 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -123.64 125.95 45.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.191 -0.943 . . . . 0.0 110.414 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.448 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -116.72 137.39 52.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.264 -0.898 . . . . 0.0 109.894 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.4 t -125.89 154.34 42.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 109.138 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 28.9 m -129.44 143.33 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.954 -1.091 . . . . 0.0 110.326 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -158.22 138.15 12.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.185 -0.947 . . . . 0.0 110.986 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.455 ' OH ' ' CB ' ' A' ' 86' ' ' GLU . 1.7 m-85 -53.53 155.73 2.86 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 121.093 -1.004 . . . . 0.0 110.424 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.17 150.98 23.01 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 119.535 -0.866 . . . . 0.0 109.652 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -105.05 -163.64 0.97 Allowed 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.16 -0.963 . . . . 0.0 110.337 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -89.51 61.24 5.48 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.159 -0.963 . . . . 0.0 110.037 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.27 -164.88 11.45 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.315 -1.514 . . . . 0.0 109.315 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 p -117.94 110.81 18.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.299 -1.118 . . . . 0.0 110.012 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.51 99.35 5.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.129 -0.982 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.36 119.29 13.85 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.0 t -59.79 128.94 39.41 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.195 -1.18 . . . . 0.0 109.83 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -62.2 148.76 43.65 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.111 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt 52.71 45.05 29.45 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.991 -1.068 . . . . 0.0 109.647 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.4 t -164.74 153.45 12.6 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.35 -0.844 . . . . 0.0 110.742 -178.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.89 48.4 0.86 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.261 -0.899 . . . . 0.0 108.582 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -144.48 -174.65 4.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.467 -0.77 . . . . 0.0 110.286 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.85 157.08 44.95 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.186 -0.946 . . . . 0.0 109.871 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.429 HG12 ' NE2' ' A' ' 52' ' ' HIS . 38.3 mt -110.56 113.51 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 109.579 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 62.1 t -134.33 90.19 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.06 -1.025 . . . . 0.0 110.569 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.87 134.6 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.348 -0.845 . . . . 0.0 111.194 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.96 -24.12 33.6 Favored Glycine 0 N--CA 1.495 2.601 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.19 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.9 t -114.38 136.95 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 CA-C-N 119.262 1.531 . . . . 0.0 110.373 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.27 139.5 39.84 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.4 -0.92 . . . . 0.0 108.851 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -107.82 137.28 46.1 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.109 -0.995 . . . . 0.0 110.811 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.5 mt -109.01 125.13 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.6 122.28 7.46 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.656 -1.377 . . . . 0.0 109.656 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.448 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.6 ttpm? -104.45 113.07 26.39 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.414 -1.05 . . . . 0.0 109.469 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.0 t -97.45 107.21 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.174 -0.954 . . . . 0.0 110.04 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.7 p -124.66 143.27 42.99 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.03 151.55 44.82 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 O-C-N 123.209 1.11 . . . . 0.0 110.412 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 . . . . . 0 N--CA 1.5 2.034 0 O-C-N 121.303 -0.873 . . . . 0.0 110.102 179.811 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.576 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -108.48 146.58 32.96 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.202 -1.175 . . . . 0.0 110.004 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.3 mtt -115.62 144.49 43.83 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.574 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -123.1 129.63 51.72 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.265 -0.897 . . . . 0.0 109.99 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -125.26 159.31 31.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.152 -0.968 . . . . 0.0 110.209 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -104.31 134.13 48.05 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.241 -0.912 . . . . 0.0 110.017 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -116.25 173.0 6.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.255 -0.903 . . . . 0.0 110.714 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.429 ' NE2' HG12 ' A' ' 25' ' ' ILE . 1.1 m170 -93.26 -171.79 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.464 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 49.3 mm -85.63 -45.0 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 C-N-CA 118.943 -1.103 . . . . 0.0 109.004 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -21.66 29.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.042 -1.037 . . . . 0.0 111.341 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.5 m -78.24 -41.69 33.5 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.753 -1.217 . . . . 0.0 109.759 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.35 -38.15 60.25 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.743 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.512 ' CD1' ' NE2' ' A' ' 93' ' ' HIS . 11.4 m-85 -71.76 -30.22 65.35 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.677 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -61.16 -37.01 81.36 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.921 -1.112 . . . . 0.0 109.497 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -58.87 -40.08 83.28 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.029 -1.044 . . . . 0.0 109.826 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.4 mp -58.96 -42.93 91.07 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.187 -0.946 . . . . 0.0 109.305 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -57.74 -34.14 69.2 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.296 -0.878 . . . . 0.0 109.68 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.05 29.68 5.75 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.212 -0.93 . . . . 0.0 110.589 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.886 0 O-C-N 120.882 -1.136 . . . . 0.0 109.971 179.77 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.9 mttt . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 120.806 0.336 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.47 HD11 HG22 ' A' ' 70' ' ' ILE . 79.0 mt 53.6 96.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.162 -0.961 . . . . 0.0 110.76 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -115.69 133.06 56.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.135 -0.978 . . . . 0.0 109.936 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 51.49 -172.9 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.076 -1.015 . . . . 0.0 110.735 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.402 ' CD2' ' CG ' ' A' ' 87' ' ' LYS . 50.4 tp -117.19 84.33 2.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.134 -0.979 . . . . 0.0 110.397 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.91 -51.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.17 -0.956 . . . . 0.0 110.744 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -51.0 -30.87 16.34 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.113 -0.992 . . . . 0.0 111.23 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.8 mt -74.73 153.87 38.65 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.919 -1.113 . . . . 0.0 109.964 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -99.38 119.05 37.34 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.198 -0.939 . . . . 0.0 111.065 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.83 -38.81 1.46 Allowed Glycine 0 N--CA 1.495 2.567 0 N-CA-C 110.266 -1.133 . . . . 0.0 110.266 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.418 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 59.7 p-90 -51.39 -34.91 36.53 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.017 -1.284 . . . . 0.0 110.937 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.418 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 6.4 tt0 -54.79 -35.9 64.33 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.982 -1.074 . . . . 0.0 110.565 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -80.54 -36.8 32.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.034 -1.041 . . . . 0.0 110.286 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HG ' ' CE2' ' A' ' 10' ' ' TYR . 7.2 mp -48.9 172.74 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.131 -0.98 . . . . 0.0 111.206 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -105.11 163.2 12.74 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.212 -0.93 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -52.42 -39.42 60.97 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.179 -0.95 . . . . 0.0 110.798 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.97 -52.13 65.28 Favored 'General case' 0 N--CA 1.508 2.455 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.635 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.455 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 14.0 tp10 -64.09 -40.97 97.38 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.435 -0.906 . . . . 0.0 109.065 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.402 ' CG ' ' CD2' ' A' ' 73' ' ' LEU . 33.3 tttt -63.99 -39.39 94.0 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.694 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.33 -40.73 97.31 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.58 -37.81 88.85 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.06 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.0 mm -64.86 -41.73 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 47.2 p -63.16 -47.08 84.19 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.426 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -64.25 -40.56 96.26 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.981 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.512 ' NE2' ' CD1' ' A' ' 57' ' ' PHE . 64.6 t60 -61.15 -43.55 98.7 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.417 ' CG1' ' CZ ' ' A' ' 57' ' ' PHE . 19.1 mt -70.44 -38.72 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 O-C-N 121.159 -0.963 . . . . 0.0 108.839 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.09 91.29 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.137 -0.977 . . . . 0.0 109.375 178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.77 -37.0 80.38 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.165 -0.959 . . . . 0.0 109.829 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.0 tp -88.07 -33.33 18.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.401 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.3 m -102.17 54.51 0.8 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.945 -1.097 . . . . 0.0 110.206 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.494 1.769 0 O-C-N 121.178 -0.951 . . . . 0.0 110.22 179.881 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 . . . . . 0 N--CA 1.494 1.738 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 mmt-85 -116.29 134.17 55.2 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.232 -0.917 . . . . 0.0 110.039 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.423 ' CE2' ' HG3' ' A' ' 34' ' ' LYS . 1.3 m-85 -116.99 144.99 43.94 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.169 -0.957 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.0 t -131.56 153.09 50.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.351 -0.843 . . . . 0.0 108.952 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 24.2 m -126.95 132.0 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 O-C-N 120.994 -1.066 . . . . 0.0 110.568 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -147.68 159.63 43.57 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.087 -1.008 . . . . 0.0 110.561 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.42 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -100.41 155.74 17.65 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.453 -0.78 . . . . 0.0 109.968 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -107.61 138.68 43.39 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.361 -0.837 . . . . 0.0 110.292 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 tttt -150.23 127.73 11.51 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.248 -0.907 . . . . 0.0 110.605 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 ttt85 54.71 99.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.093 -1.004 . . . . 0.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.86 -151.41 23.55 Favored Glycine 0 N--CA 1.496 2.665 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -158.02 138.44 12.72 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.195 -1.179 . . . . 0.0 110.593 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.98 107.16 4.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.157 -0.964 . . . . 0.0 110.539 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.67 114.72 7.13 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 24.6 t -61.06 128.49 36.71 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.207 -1.172 . . . . 0.0 109.521 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.419 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 19.1 tptt -61.8 148.09 44.27 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.196 -0.94 . . . . 0.0 109.091 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.3 mttt 52.74 45.62 28.35 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.946 -1.096 . . . . 0.0 109.669 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.8 t -165.21 154.08 12.21 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.362 -0.836 . . . . 0.0 110.783 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -105.5 44.04 1.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -141.43 -177.11 4.99 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.015 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -126.71 161.68 27.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.019 -1.051 . . . . 0.0 110.264 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.417 HG12 ' CD2' ' A' ' 52' ' ' HIS . 7.1 mt -120.17 102.92 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.409 -0.807 . . . . 0.0 109.997 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.5 p -162.32 143.93 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.24 -0.913 . . . . 0.0 111.266 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.9 tptp 52.84 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.261 -0.9 . . . . 0.0 111.558 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.51 9.31 83.59 Favored Glycine 0 N--CA 1.496 2.652 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.061 179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.9 t -124.49 135.14 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 119.891 1.846 . . . . 0.0 110.582 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.4 t -102.0 140.01 36.87 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.301 -0.875 . . . . 0.0 108.767 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.23 150.33 50.65 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.124 -0.985 . . . . 0.0 111.401 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 19.2 mt -110.81 138.27 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.444 -0.785 . . . . 0.0 108.997 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.12 125.89 8.56 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.165 -1.574 . . . . 0.0 109.165 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.423 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 22.0 ttmt -107.51 120.54 42.47 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.238 -1.154 . . . . 0.0 109.804 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.5 t -101.63 107.5 21.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.058 -1.026 . . . . 0.0 110.28 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.4 p -124.66 143.5 43.66 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.96 126.36 11.2 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 O-C-N 123.089 1.047 . . . . 0.0 110.228 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 N--CA 1.5 2.03 0 O-C-N 121.165 -0.959 . . . . 0.0 110.231 179.834 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.466 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -115.78 138.85 50.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.259 -1.142 . . . . 0.0 110.257 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.6 ttt -117.25 143.62 45.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.221 -0.924 . . . . 0.0 110.385 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -117.99 128.51 54.85 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.249 -0.907 . . . . 0.0 110.139 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -122.95 148.59 45.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.21 -0.931 . . . . 0.0 109.777 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 23.4 m95 -94.23 163.25 13.52 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.137 -0.977 . . . . 0.0 109.94 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.419 ' CE1' ' HB3' ' A' ' 19' ' ' LYS . 89.0 m-85 -146.29 174.82 11.01 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.307 -0.871 . . . . 0.0 110.459 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.417 ' CD2' HG12 ' A' ' 25' ' ' ILE . 1.8 m80 -99.44 -175.79 3.1 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.331 -0.855 . . . . 0.0 108.831 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.508 HG23 ' NE2' ' A' ' 93' ' ' HIS . 49.8 mm -83.98 -34.34 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 O-C-N 121.076 -1.015 . . . . 0.0 109.582 178.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -91.38 -32.45 15.65 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.695 -1.253 . . . . 0.0 110.594 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.9 m -63.46 -52.38 61.65 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.959 -1.088 . . . . 0.0 110.744 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 11.7 tpt -67.76 -38.27 83.23 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.42 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.427 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 13.2 m-85 -76.77 -27.0 55.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.015 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -75.21 -37.12 61.27 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.836 -1.165 . . . . 0.0 109.407 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -40.85 82.32 Favored 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.31 179.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 tp -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.405 -0.809 . . . . 0.0 109.606 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -70.31 -33.32 71.38 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.181 -0.949 . . . . 0.0 110.424 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -30.62 21.31 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.11 -0.994 . . . . 0.0 111.059 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.995 0 O-C-N 120.877 -1.139 . . . . 0.0 110.434 -179.862 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mttp . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 120.749 0.309 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.7 mt 55.69 99.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.179 -0.951 . . . . 0.0 110.538 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.55 143.62 44.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.205 -0.934 . . . . 0.0 110.001 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.26 -172.33 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.093 -1.005 . . . . 0.0 110.423 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.403 ' CD2' ' CG ' ' A' ' 87' ' ' LYS . 13.2 tp -122.54 37.38 4.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.218 -0.926 . . . . 0.0 110.71 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -144.42 36.56 1.21 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.085 -1.01 . . . . 0.0 110.404 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -134.98 33.53 3.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.245 -0.909 . . . . 0.0 110.101 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.4 ' CD2' ' HB3' ' A' ' 6' ' ' PHE . 55.2 mt -138.91 156.36 47.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.093 -1.004 . . . . 0.0 109.729 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -86.55 104.66 16.2 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.167 -0.958 . . . . 0.0 110.875 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.97 -30.12 2.28 Favored Glycine 0 N--CA 1.495 2.604 0 C-N-CA 119.519 -1.324 . . . . 0.0 111.806 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.435 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 19.0 p-90 -57.65 -34.23 69.13 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 119.492 1.646 . . . . 0.0 110.761 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.435 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 23.5 tt0 -55.78 -35.61 66.46 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.943 -1.098 . . . . 0.0 110.487 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -74.49 -32.77 62.65 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.03 -1.044 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.8 174.44 0.02 OUTLIER 'General case' 0 N--CA 1.519 2.979 0 O-C-N 120.971 -1.081 . . . . 0.0 110.913 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -105.43 161.77 14.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.175 -0.953 . . . . 0.0 110.452 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.54 -50.12 74.91 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.226 -0.921 . . . . 0.0 110.347 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -61.18 -37.2 82.06 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.238 -0.914 . . . . 0.0 110.203 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 55.4 mt-10 -73.27 -41.22 63.88 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.132 -0.98 . . . . 0.0 108.805 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.403 ' CG ' ' CD2' ' A' ' 73' ' ' LEU . 34.7 tttt -58.89 -34.86 72.13 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.372 -0.83 . . . . 0.0 109.949 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -65.13 -35.6 81.62 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.091 -1.006 . . . . 0.0 109.987 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -67.51 -47.31 70.33 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.981 -1.074 . . . . 0.0 110.083 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.2 tt -63.98 -34.43 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.437 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.823 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.35 -39.38 94.39 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.912 -1.117 . . . . 0.0 109.179 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -55.77 -38.63 70.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.141 -0.974 . . . . 0.0 109.969 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.508 ' NE2' HG23 ' A' ' 53' ' ' ILE . 2.4 m-70 -60.69 -53.33 58.69 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.196 -0.94 . . . . 0.0 109.837 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.427 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.6 mt -61.94 -38.73 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.484 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.24 93.18 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.156 -0.965 . . . . 0.0 109.508 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.53 -43.4 76.82 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.234 -0.916 . . . . 0.0 108.797 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.6 tp -60.56 -34.97 74.94 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.282 -0.886 . . . . 0.0 109.962 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.7 m -98.14 50.91 1.02 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.088 -1.007 . . . . 0.0 110.116 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 9.5 t . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.125 -0.985 . . . . 0.0 110.056 -179.957 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 . . . . . 0 N--CA 1.497 1.922 0 CA-C-O 120.615 0.245 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -125.08 143.99 50.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.208 -0.933 . . . . 0.0 110.165 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.413 ' CE2' ' HD2' ' A' ' 34' ' ' LYS . 1.7 m-85 -118.78 149.57 41.27 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.289 -0.882 . . . . 0.0 110.209 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.4 m -135.41 164.81 26.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.254 -0.904 . . . . 0.0 109.421 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.9 p -139.29 112.87 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.053 -1.03 . . . . 0.0 110.231 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -125.77 142.97 51.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 109.699 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.423 ' CD1' ' HB3' ' A' ' 82' ' ' LEU . 95.9 m-85 -99.6 137.75 37.65 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.229 -0.919 . . . . 0.0 109.667 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.58 134.66 46.72 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.043 -1.036 . . . . 0.0 110.742 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 32.4 tttt -119.63 -58.02 1.93 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.239 -0.913 . . . . 0.0 110.014 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -147.82 38.61 0.92 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.219 -0.925 . . . . 0.0 110.513 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -146.92 157.56 27.45 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.4 p -140.53 140.73 35.28 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.21 -1.171 . . . . 0.0 110.205 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -161.0 151.12 17.56 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.206 -0.934 . . . . 0.0 111.398 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -54.46 127.02 38.74 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 108.822 -1.711 . . . . 0.0 108.822 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.864 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 23.4 p -64.53 127.9 33.49 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.272 -1.134 . . . . 0.0 110.826 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 1.2 mptm? -75.82 156.51 34.39 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.52 -0.738 . . . . 0.0 109.308 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 tptp 65.89 16.25 10.4 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.904 -1.122 . . . . 0.0 111.529 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.864 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 9.3 p -174.83 149.14 1.14 Allowed 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.572 -1.33 . . . . 0.0 110.646 178.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 tttt -85.07 88.84 7.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.986 -1.071 . . . . 0.0 111.776 -177.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -166.97 -174.56 2.73 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.277 -0.889 . . . . 0.0 110.408 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.09 152.73 47.63 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.039 -1.038 . . . . 0.0 109.656 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.9 mt -105.25 118.82 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.344 -0.847 . . . . 0.0 110.024 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.2 t -115.65 159.0 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.228 -0.92 . . . . 0.0 109.96 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -49.99 132.94 23.1 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.28 -0.888 . . . . 0.0 110.752 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.37 9.7 40.76 Favored Glycine 0 N--CA 1.494 2.531 0 C-N-CA 120.083 -1.056 . . . . 0.0 111.591 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.8 p -123.65 135.13 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 CA-C-N 119.682 1.741 . . . . 0.0 110.536 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.412 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 23.8 p -87.01 141.59 28.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.229 -0.92 . . . . 0.0 110.239 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -138.85 144.52 39.26 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -0.943 . . . . 0.0 110.349 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.411 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 12.2 mt -106.51 126.9 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.222 -0.924 . . . . 0.0 109.277 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.0 133.74 11.54 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.251 -1.539 . . . . 0.0 109.251 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.441 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 33.0 tttt -103.77 121.83 43.83 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.159 -1.201 . . . . 0.0 109.298 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.97 112.6 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.154 -0.966 . . . . 0.0 110.411 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.3 t -120.37 141.4 31.86 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.141 -0.975 . . . . 0.0 109.727 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -74.63 129.64 12.89 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.259 1.137 . . . . 0.0 110.431 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 . . . . . 0 N--CA 1.499 1.991 0 O-C-N 121.149 -0.969 . . . . 0.0 110.107 179.594 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.52 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -107.6 146.96 31.25 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.228 -1.16 . . . . 0.0 110.068 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.4 ttm -117.08 151.51 36.66 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.187 -0.946 . . . . 0.0 110.608 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.423 ' HD2' ' CZ2' ' A' ' 50' ' ' TRP . 7.8 pttt -131.71 142.7 49.87 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.341 -0.849 . . . . 0.0 109.905 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -120.8 134.23 55.3 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.102 -0.999 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.423 ' CZ2' ' HD2' ' A' ' 48' ' ' LYS . 17.0 m95 -91.56 114.47 27.01 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.074 -1.016 . . . . 0.0 110.591 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.441 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.8 OUTLIER -125.44 171.0 10.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.611 177.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.462 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 71.0 m80 -87.74 -173.5 4.34 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.49 -0.756 . . . . 0.0 110.028 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.452 HG23 ' CD2' ' A' ' 93' ' ' HIS . 30.8 mm -84.61 -52.75 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -60.22 -37.85 81.57 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.222 -0.924 . . . . 0.0 109.259 178.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -61.49 -51.29 69.26 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.25 -0.906 . . . . 0.0 109.083 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.412 ' HB2' ' CD1' ' A' ' 51' ' ' TYR . 9.0 tpt -68.94 -44.41 73.1 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.339 -0.851 . . . . 0.0 109.302 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 10.6 m-85 -64.12 -29.72 70.83 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 119.157 -1.017 . . . . 0.0 109.721 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.48 -40.09 85.86 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.989 -1.069 . . . . 0.0 109.391 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -66.22 -40.17 90.1 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.236 -0.915 . . . . 0.0 109.114 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.6 mp -57.8 -42.18 83.65 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.205 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -58.84 -35.65 73.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.221 -0.924 . . . . 0.0 109.53 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -105.23 30.56 5.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.228 -0.92 . . . . 0.0 110.457 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.78 0 O-C-N 121.022 -1.049 . . . . 0.0 110.072 179.967 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 120.692 0.282 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.42 HG22 HD11 ' A' ' 70' ' ' ILE . 77.7 mt 54.49 100.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.079 0 O-C-N 121.197 -0.939 . . . . 0.0 110.804 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -107.02 134.09 50.69 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.126 -0.984 . . . . 0.0 109.577 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 53.83 -163.65 0.1 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.996 -1.065 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.1 tp -103.87 73.87 1.19 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.984 -1.073 . . . . 0.0 109.811 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.85 -160.0 0.32 Allowed 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.182 -0.949 . . . . 0.0 110.406 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 54.6 38.89 30.7 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.911 -1.118 . . . . 0.0 110.238 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 tp -141.85 150.92 42.22 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.304 -0.873 . . . . 0.0 109.412 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -100.89 104.47 15.68 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.137 -0.977 . . . . 0.0 110.829 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.78 -37.97 1.61 Allowed Glycine 0 N--CA 1.493 2.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.51 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -62.15 -28.18 69.47 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.931 -1.335 . . . . 0.0 111.022 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -51.42 -32.27 25.87 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.853 -1.154 . . . . 0.0 111.87 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -165.1 50.94 0.11 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.62 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.423 ' HB3' ' CD1' ' A' ' 10' ' ' TYR . 18.0 mt -118.31 -67.73 0.97 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.842 -1.162 . . . . 0.0 109.604 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.421 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 5.1 tp10 -121.0 127.81 52.12 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.143 -0.973 . . . . 0.0 109.815 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.4 -50.33 6.18 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.079 -1.013 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.49 -46.43 88.49 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.193 -0.942 . . . . 0.0 109.628 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -62.76 -36.92 84.63 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.438 -0.905 . . . . 0.0 109.722 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.6 ttpt -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.141 -0.974 . . . . 0.0 109.793 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.61 -41.73 97.87 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.18 -0.95 . . . . 0.0 109.558 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -61.01 -36.2 78.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.234 -0.916 . . . . 0.0 110.181 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 44.9 mt -60.11 -38.04 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.081 -1.012 . . . . 0.0 109.775 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -39.91 86.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 120.905 -1.122 . . . . 0.0 109.771 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -59.66 -38.38 81.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 109.737 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.452 ' CD2' HG23 ' A' ' 53' ' ' ILE . 20.7 m-70 -56.46 -47.18 79.71 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.157 -0.964 . . . . 0.0 110.137 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -64.88 -39.75 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.182 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.38 -40.43 81.39 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.16 -0.962 . . . . 0.0 109.383 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -64.25 -40.17 95.46 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.251 -0.906 . . . . 0.0 109.515 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.2 tp -71.09 -33.38 70.12 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.247 -0.908 . . . . 0.0 110.233 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 40.3 t -102.76 40.06 1.43 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.047 -1.033 . . . . 0.0 110.171 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 N--CA 1.499 2.016 0 O-C-N 121.177 -0.952 . . . . 0.0 110.842 179.966 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -130.43 148.41 52.24 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.163 -0.961 . . . . 0.0 110.295 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.523 ' CE2' ' OH ' ' A' ' 51' ' ' TYR . 2.8 m-85 -114.09 153.48 29.4 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.316 -0.865 . . . . 0.0 110.25 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -135.69 124.68 24.24 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.438 -0.789 . . . . 0.0 109.318 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 20.5 m -101.16 134.57 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 O-C-N 121.222 -0.924 . . . . 0.0 110.736 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -143.89 108.4 4.85 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.449 ' OH ' ' CB ' ' A' ' 86' ' ' GLU . 11.6 m-85 -56.08 158.85 3.68 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.105 -0.997 . . . . 0.0 110.304 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.32 119.01 32.46 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.363 -0.836 . . . . 0.0 110.007 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -111.14 -53.11 2.74 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.165 -0.96 . . . . 0.0 110.39 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -139.93 96.5 3.07 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.184 -0.947 . . . . 0.0 110.191 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 143.45 122.33 1.66 Allowed Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.8 p -115.78 144.2 44.32 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.198 -1.178 . . . . 0.0 109.875 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -154.86 151.49 28.66 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.219 -0.926 . . . . 0.0 111.228 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.98 125.19 32.45 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 108.696 -1.761 . . . . 0.0 108.696 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.857 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 23.8 p -63.85 126.96 29.3 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.198 -1.178 . . . . 0.0 110.892 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.423 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 37.8 mmtt -74.89 156.27 36.57 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.601 -0.687 . . . . 0.0 109.178 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.46 15.54 10.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.938 -1.101 . . . . 0.0 111.601 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.857 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.6 p -174.88 150.39 1.25 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.515 -1.366 . . . . 0.0 110.767 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 89.64 7.88 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.043 -1.036 . . . . 0.0 111.668 -178.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -167.02 -173.95 2.51 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.312 -0.867 . . . . 0.0 110.289 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -130.05 149.19 51.87 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.074 -1.016 . . . . 0.0 109.819 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.2 mt -101.24 120.74 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.194 -0.941 . . . . 0.0 109.711 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.8 t -108.57 157.02 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.233 -0.917 . . . . 0.0 110.061 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.3 mtpp -51.39 126.73 17.89 Favored 'General case' 0 N--CA 1.514 2.747 0 O-C-N 121.273 -0.892 . . . . 0.0 110.704 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 104.3 9.67 35.71 Favored Glycine 0 N--CA 1.496 2.649 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.843 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.6 p -113.78 135.03 54.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.783 1.792 . . . . 0.0 110.436 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.432 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.3 p -78.36 133.77 37.53 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.193 -0.942 . . . . 0.0 109.903 179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.3 ptt-85 -132.24 140.33 48.62 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.157 -0.964 . . . . 0.0 110.18 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.418 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 9.9 mt -107.83 125.24 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.26 -0.9 . . . . 0.0 109.447 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.57 144.86 15.89 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.443 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -119.43 135.21 54.85 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.118 -1.225 . . . . 0.0 109.453 179.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.7 t -111.98 111.78 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.943 -1.098 . . . . 0.0 110.241 -179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.5 t -116.45 112.41 41.36 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.242 -0.912 . . . . 0.0 109.758 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.94 126.08 10.96 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 123.232 1.122 . . . . 0.0 110.503 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 . . . . . 0 N--CA 1.498 1.969 0 O-C-N 121.187 -0.946 . . . . 0.0 110.01 179.615 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.476 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -132.45 143.62 49.91 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.183 -1.187 . . . . 0.0 110.264 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.7 mmm -117.84 135.43 54.09 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.222 -0.923 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.77 143.87 45.14 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.258 -0.901 . . . . 0.0 109.713 179.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -132.09 137.75 47.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.088 -1.007 . . . . 0.0 110.459 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 25.8 m95 -94.05 117.19 29.76 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.087 -1.008 . . . . 0.0 110.82 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.523 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.92 172.38 10.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.032 -1.042 . . . . 0.0 109.689 177.679 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.465 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.1 m80 -88.96 -173.11 3.95 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.335 -0.853 . . . . 0.0 110.238 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.461 HG22 HD11 ' A' ' 53' ' ' ILE . 23.0 mm -86.13 -50.77 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -61.87 -38.47 88.39 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.097 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.1 m -61.78 -50.94 70.32 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.172 -0.955 . . . . 0.0 108.98 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' MET . . . . . 0.411 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -67.28 -45.42 76.67 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.465 -0.772 . . . . 0.0 109.655 179.796 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.67 -28.65 68.63 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 119.214 -0.995 . . . . 0.0 110.023 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.09 -42.43 76.18 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 120.896 -1.128 . . . . 0.0 108.894 178.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -74.97 -42.32 57.83 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.8 tp -62.39 -38.89 91.38 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.407 -0.808 . . . . 0.0 109.143 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -67.03 -32.73 74.14 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.183 -0.948 . . . . 0.0 110.131 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -102.42 16.37 26.47 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.046 -1.034 . . . . 0.0 111.699 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.812 0 O-C-N 120.668 -1.27 . . . . 0.0 110.131 179.727 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 120.808 0.337 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.425 HG23 HD11 ' A' ' 70' ' ' ILE . 75.1 mt 55.28 99.22 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.147 -0.971 . . . . 0.0 110.613 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -110.2 134.6 52.06 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.264 -0.898 . . . . 0.0 109.685 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.47 -164.75 0.09 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.059 -1.026 . . . . 0.0 110.206 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.423 HD23 ' OG1' ' A' ' 91' ' ' THR . 25.9 tp -121.7 53.84 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.08 -1.012 . . . . 0.0 110.765 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.42 37.03 0.47 Allowed 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.175 -0.953 . . . . 0.0 110.755 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -133.63 30.27 3.8 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.1 -1.0 . . . . 0.0 110.533 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.7 mt -134.08 154.68 51.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.015 -1.053 . . . . 0.0 109.722 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -86.2 104.01 15.35 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.194 -0.941 . . . . 0.0 110.502 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 148.2 -36.77 1.1 Allowed Glycine 0 N--CA 1.493 2.498 0 C-N-CA 119.766 -1.207 . . . . 0.0 110.893 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.459 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 17.3 p-90 -57.88 -35.23 70.7 Favored 'General case' 0 N--CA 1.509 2.511 0 CA-C-N 119.034 1.417 . . . . 0.0 110.838 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.459 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 1.9 tp10 -74.92 -29.38 60.95 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.021 -1.05 . . . . 0.0 110.862 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -99.01 -25.59 14.51 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.917 -1.114 . . . . 0.0 112.004 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.431 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 64.2 mt -76.21 -175.57 3.22 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.679 -1.263 . . . . 0.0 110.273 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -63.31 152.74 37.04 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.188 -0.945 . . . . 0.0 110.345 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -88.26 -40.18 13.85 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.189 -0.944 . . . . 0.0 110.22 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -60.17 -51.51 69.26 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.218 -0.926 . . . . 0.0 109.842 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.449 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 42.8 mt-10 -61.49 -40.0 92.99 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.254 -0.903 . . . . 0.0 109.326 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -59.56 -41.07 89.32 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.328 -0.857 . . . . 0.0 109.535 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -54.54 -33.6 60.37 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.209 -0.932 . . . . 0.0 110.364 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -57.63 -37.62 73.61 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.994 -1.066 . . . . 0.0 110.206 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.2 mt -62.36 -36.79 76.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.119 -0.988 . . . . 0.0 109.511 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.423 ' OG1' HD23 ' A' ' 73' ' ' LEU . 28.0 m -58.15 -38.13 76.01 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.899 -1.125 . . . . 0.0 109.6 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -57.79 -38.11 74.9 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.302 -0.874 . . . . 0.0 109.765 179.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.445 ' CD2' HG23 ' A' ' 53' ' ' ILE . 5.7 m-70 -58.56 -53.5 57.58 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -61.92 -38.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.396 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.95 92.67 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.176 -0.952 . . . . 0.0 109.774 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -60.94 -39.33 89.07 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.157 -0.964 . . . . 0.0 109.798 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.02 -34.58 68.94 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 110.349 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.5 t -101.07 62.84 0.98 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.025 -1.047 . . . . 0.0 110.197 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.1 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.144 -0.972 . . . . 0.0 110.223 -179.973 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.1 mtp85 -120.06 145.66 46.65 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.185 -0.947 . . . . 0.0 110.273 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.506 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 1.4 m-85 -125.37 142.38 51.53 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.301 -0.874 . . . . 0.0 110.133 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.3 t -125.66 157.51 37.09 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.239 -0.913 . . . . 0.0 109.938 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 52.0 t -113.31 116.72 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.121 -0.987 . . . . 0.0 110.03 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.418 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 3.9 t70 -123.72 148.44 46.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.143 -0.973 . . . . 0.0 110.113 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.426 ' OH ' ' HB3' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -105.3 142.48 34.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.273 -0.892 . . . . 0.0 109.646 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.66 126.94 29.72 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.123 -0.986 . . . . 0.0 110.355 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -137.85 109.28 6.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.299 -0.876 . . . . 0.0 110.143 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 37.69 41.56 0.32 Allowed 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.62 164.77 26.62 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.3 m -144.4 122.43 12.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.124 -1.221 . . . . 0.0 110.347 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -153.21 139.44 18.43 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.185 -0.947 . . . . 0.0 111.133 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.99 129.13 49.1 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.906 -1.677 . . . . 0.0 108.906 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.952 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 32.0 p -66.79 119.84 12.51 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.156 -1.202 . . . . 0.0 111.118 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 12.6 mmtp -68.25 159.41 31.3 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.271 -0.893 . . . . 0.0 109.192 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 tptt 63.59 19.38 11.68 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.524 -1.36 . . . . 0.0 110.757 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.952 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.5 p -177.47 153.42 0.91 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 120.575 -1.328 . . . . 0.0 110.716 178.195 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -91.83 86.71 5.99 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.011 -1.055 . . . . 0.0 111.65 -178.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -165.51 -172.52 2.46 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.278 -0.889 . . . . 0.0 110.516 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.9 ttpt -127.65 155.9 43.18 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.139 -0.976 . . . . 0.0 109.978 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 70.5 mt -107.25 124.96 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.041 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.1 m -130.29 156.13 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.233 -0.917 . . . . 0.0 110.144 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ttpt -48.96 129.22 17.14 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.336 -0.853 . . . . 0.0 110.855 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 116.83 -8.26 16.84 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.573 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.3 p -125.09 134.85 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-N 119.795 1.797 . . . . 0.0 110.572 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 30.7 p -76.86 142.74 40.08 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.071 -1.018 . . . . 0.0 110.245 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.6 ptt180 -136.42 146.33 46.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.16 -0.962 . . . . 0.0 110.381 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.436 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 30.6 mt -113.81 132.69 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.287 -0.883 . . . . 0.0 109.902 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.8 155.5 16.08 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.437 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.0 ttpm? -118.26 130.74 56.23 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.187 -1.184 . . . . 0.0 109.781 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.24 107.96 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.121 -0.987 . . . . 0.0 109.983 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.3 p -123.97 143.33 42.0 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.221 -0.925 . . . . 0.0 110.027 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.12 146.91 47.42 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.228 1.12 . . . . 0.0 110.331 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 . . . . . 0 N--CA 1.5 2.071 0 O-C-N 121.288 -0.883 . . . . 0.0 110.241 179.863 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.475 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -117.0 131.63 56.91 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.221 -1.164 . . . . 0.0 110.127 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 tpt -117.31 151.66 36.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.096 -1.002 . . . . 0.0 110.423 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.8 pttt -131.3 141.93 50.03 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.271 -0.893 . . . . 0.0 110.163 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -120.08 164.58 15.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.0 109.757 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.418 ' CZ3' ' HB2' ' A' ' 9' ' ' ASP . 18.3 m95 -113.9 128.25 56.32 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.065 -1.022 . . . . 0.0 110.735 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.506 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 7.0 p90 -151.94 173.42 14.85 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.492 177.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.438 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 47.9 m80 -80.91 176.71 9.58 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.579 -0.701 . . . . 0.0 112.555 -176.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.434 HG21 ' NE2' ' A' ' 93' ' ' HIS . 21.1 mt -88.73 -53.95 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -54.72 -36.53 64.84 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.053 -1.029 . . . . 0.0 109.583 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 7.2 m -63.02 -51.68 65.86 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.313 -0.867 . . . . 0.0 109.15 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 7.5 tpt -69.03 -42.35 76.49 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.736 -0.786 . . . . 0.0 109.459 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.428 ' CE2' HG22 ' A' ' 53' ' ' ILE . 12.8 m-85 -67.46 -30.57 70.32 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.981 179.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.94 -40.79 62.82 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.859 -1.15 . . . . 0.0 109.059 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -58.66 -39.31 80.26 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.369 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -53.59 -41.87 67.05 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.158 -0.964 . . . . 0.0 109.263 178.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.5 -36.08 75.37 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.257 -0.902 . . . . 0.0 109.5 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.18 33.2 4.41 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.229 -0.92 . . . . 0.0 110.345 179.276 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.093 0 O-C-N 120.981 -1.075 . . . . 0.0 110.499 -179.879 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 120.899 0.381 . . . . 0.0 110.816 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.7 mt -89.52 124.0 42.01 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.255 -0.903 . . . . 0.0 109.877 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -116.36 148.25 40.8 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.263 -0.898 . . . . 0.0 110.188 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.14 177.34 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.079 -1.013 . . . . 0.0 110.683 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 61.5 tp -127.85 87.81 2.67 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.207 -0.933 . . . . 0.0 110.368 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -172.38 -51.35 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.199 -0.938 . . . . 0.0 110.84 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.87 -35.65 33.86 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 121.027 -1.046 . . . . 0.0 110.603 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.15 150.89 44.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.131 -0.981 . . . . 0.0 109.659 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -101.96 123.51 45.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.18 -0.95 . . . . 0.0 110.174 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 135.78 -36.86 1.97 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.47 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 43.0 p-90 -56.37 -37.37 69.97 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.939 -1.33 . . . . 0.0 110.685 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.47 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 2.9 tm-20 -71.87 -37.41 70.21 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.7 -29.14 69.07 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.184 -0.947 . . . . 0.0 111.037 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.421 HD11 ' CD2' ' A' ' 10' ' ' TYR . 85.0 mt -81.39 -173.77 4.55 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.851 -1.155 . . . . 0.0 110.262 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.54 162.36 12.96 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.204 -0.935 . . . . 0.0 110.469 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -86.6 -41.1 14.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.273 -0.892 . . . . 0.0 110.137 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -60.83 -47.62 85.53 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.267 -0.895 . . . . 0.0 109.435 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.426 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 17.6 mt-10 -60.61 -39.05 86.76 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.356 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -56.17 -40.09 73.35 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.412 ' O ' ' OG1' ' A' ' 91' ' ' THR . 9.2 mt-10 -56.93 -36.07 69.79 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.218 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.58 -36.14 75.65 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.002 -1.061 . . . . 0.0 110.424 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 53.4 mt -65.26 -40.08 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.03 -1.044 . . . . 0.0 109.565 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 0.1 OUTLIER -60.57 -44.37 96.26 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.026 -1.046 . . . . 0.0 109.081 179.458 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -64.82 -39.63 93.89 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.434 ' NE2' HG21 ' A' ' 53' ' ' ILE . 16.8 t60 -57.08 -48.0 79.65 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.23 -0.919 . . . . 0.0 109.742 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.405 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 11.6 mt -65.09 -38.49 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.281 -0.967 . . . . 0.0 109.132 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.12 84.79 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.189 -0.944 . . . . 0.0 109.666 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.05 -37.38 82.42 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.236 -0.915 . . . . 0.0 110.002 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.6 tp -81.42 -38.27 26.76 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.061 -1.024 . . . . 0.0 110.112 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 30.4 t -74.61 -38.25 62.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.496 1.87 0 O-C-N 121.136 -0.977 . . . . 0.0 110.03 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 . . . . . 0 N--CA 1.494 1.764 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.55 139.51 52.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.16 -0.962 . . . . 0.0 110.143 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.409 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 1.9 m-85 -119.74 154.66 33.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.182 -0.948 . . . . 0.0 110.326 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -143.76 134.29 24.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.318 -0.864 . . . . 0.0 110.298 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 47.7 t -102.5 105.76 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.223 -0.923 . . . . 0.0 109.671 179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -118.02 159.45 23.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.14 -0.975 . . . . 0.0 110.874 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.424 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -106.73 149.1 27.65 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.545 -0.722 . . . . 0.0 109.637 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.43 123.74 27.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.173 -0.954 . . . . 0.0 109.953 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -149.65 39.36 0.79 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.183 -0.948 . . . . 0.0 110.588 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -136.38 -66.03 0.55 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.215 -0.928 . . . . 0.0 110.156 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.69 -137.67 2.52 Favored Glycine 0 N--CA 1.497 2.745 0 N-CA-C 110.064 -1.215 . . . . 0.0 110.064 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.3 p -122.78 116.22 23.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.231 -1.158 . . . . 0.0 110.038 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 134.67 54.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.131 -0.981 . . . . 0.0 110.653 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.27 123.12 31.55 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 108.527 -1.829 . . . . 0.0 108.527 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.846 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 26.3 p -64.59 129.09 38.5 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.29 -1.123 . . . . 0.0 110.914 -178.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 35.5 mmtt -75.45 156.02 35.7 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.578 -0.701 . . . . 0.0 109.251 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 65.76 15.82 10.22 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.85 -1.156 . . . . 0.0 111.704 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.846 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.8 p -174.91 151.27 1.35 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.557 -1.339 . . . . 0.0 110.752 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -87.1 90.73 8.46 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.053 -1.029 . . . . 0.0 111.647 -177.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 0.4 OUTLIER -167.62 -174.0 2.35 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.332 -0.855 . . . . 0.0 110.412 178.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -126.08 154.03 43.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.989 -1.07 . . . . 0.0 110.036 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.4 mt -109.86 103.09 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.404 -0.81 . . . . 0.0 109.912 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.9 m -110.98 162.98 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.259 -0.901 . . . . 0.0 110.397 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -49.6 137.27 15.73 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.415 -0.803 . . . . 0.0 111.033 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.36 50.74 Favored Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.184 -1.007 . . . . 0.0 111.499 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.1 p -126.86 137.36 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.73 1.765 . . . . 0.0 110.786 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.417 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 42.3 t -93.49 138.98 31.25 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.237 -0.914 . . . . 0.0 109.774 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.437 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 4.1 ptt180 -135.09 147.78 49.64 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.258 -0.901 . . . . 0.0 110.348 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.408 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 15.1 mt -106.33 123.83 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.313 -0.867 . . . . 0.0 109.523 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.24 137.22 13.32 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 37.4 ttpt -107.26 124.2 49.42 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.233 -1.157 . . . . 0.0 109.379 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.4 t -99.98 114.45 38.48 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.069 -1.019 . . . . 0.0 110.321 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.2 p -121.82 138.18 28.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.292 -0.88 . . . . 0.0 110.345 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.2 151.28 34.1 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 O-C-N 123.003 1.002 . . . . 0.0 110.458 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 . . . . . 0 N--CA 1.5 2.025 0 O-C-N 121.298 -0.876 . . . . 0.0 110.088 179.748 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.528 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.76 143.83 44.44 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.255 -1.144 . . . . 0.0 109.986 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 mmt -116.82 139.08 51.02 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.172 -0.955 . . . . 0.0 110.285 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.412 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 6.1 ttmm -129.37 130.64 46.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.276 -0.89 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -114.68 138.74 50.34 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.204 -0.935 . . . . 0.0 109.82 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 11.5 m95 -93.98 112.76 24.63 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.191 -0.943 . . . . 0.0 110.852 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.432 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -123.54 170.93 9.92 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.47 177.064 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.473 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.0 m80 -88.97 -173.88 4.25 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.442 -0.786 . . . . 0.0 110.338 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 34.7 mm -83.22 -54.61 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 tttp -60.07 -37.5 80.05 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.292 -0.88 . . . . 0.0 109.398 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 19.4 m -60.75 -51.22 70.28 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.208 -0.932 . . . . 0.0 109.14 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 11.3 tpt -69.21 -45.43 69.87 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.365 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.423 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 11.2 m-85 -63.21 -29.88 71.13 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.833 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -62.84 -41.55 99.39 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.885 -1.134 . . . . 0.0 109.122 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -40.88 92.11 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.226 -0.921 . . . . 0.0 108.927 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -55.78 -41.71 74.49 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.139 -0.976 . . . . 0.0 109.237 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.26 -35.45 71.76 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.314 -0.866 . . . . 0.0 109.581 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.7 mmt85 -105.97 31.16 5.27 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.196 -0.94 . . . . 0.0 110.544 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.853 0 O-C-N 120.987 -1.071 . . . . 0.0 110.086 179.939 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.776 0.322 . . . . 0.0 110.284 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.408 HG22 HD11 ' A' ' 70' ' ' ILE . 78.3 mt 54.21 99.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.08 -1.013 . . . . 0.0 110.782 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -107.43 139.18 42.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.188 -0.945 . . . . 0.0 109.403 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.62 -163.99 0.12 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.964 -1.085 . . . . 0.0 110.053 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.42 HD21 ' OG1' ' A' ' 91' ' ' THR . 56.4 tp -116.08 70.84 0.76 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.034 -1.041 . . . . 0.0 110.473 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.68 -163.7 0.34 Allowed 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.229 -0.92 . . . . 0.0 110.314 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 54.44 37.45 27.76 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.996 -1.065 . . . . 0.0 110.259 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -145.22 151.53 38.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.197 -0.94 . . . . 0.0 109.74 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -94.49 97.18 9.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.123 -0.985 . . . . 0.0 109.99 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.12 -36.56 0.95 Allowed Glycine 0 N--CA 1.495 2.627 0 C-N-CA 119.72 -1.229 . . . . 0.0 110.752 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 52.8 p-90 -56.01 -34.78 66.14 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.921 1.36 . . . . 0.0 110.616 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.41 -43.81 96.42 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.052 -1.03 . . . . 0.0 109.439 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -60.45 -39.75 88.68 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.14 -0.975 . . . . 0.0 109.75 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.5 mp -49.38 173.56 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.907 0 O-C-N 121.219 -0.926 . . . . 0.0 110.643 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -101.23 161.0 13.93 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.069 -1.019 . . . . 0.0 110.383 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -55.59 -36.18 66.61 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.181 -0.949 . . . . 0.0 110.967 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -70.41 -43.48 69.9 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.063 -1.023 . . . . 0.0 109.452 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.424 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 22.2 mt-10 -70.64 -39.35 73.71 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.839 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -61.81 -37.43 84.38 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.286 -0.884 . . . . 0.0 109.853 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -65.91 -40.25 91.32 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.149 -0.969 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.33 79.72 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.241 -0.912 . . . . 0.0 110.538 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 98.5 mt -68.19 -36.99 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 O-C-N 121.113 -0.992 . . . . 0.0 109.434 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.42 ' OG1' HD21 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -61.43 -38.92 88.89 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.886 -1.134 . . . . 0.0 109.451 179.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -57.39 -37.96 73.51 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.164 -0.96 . . . . 0.0 109.874 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.459 ' CE1' ' CG2' ' A' ' 53' ' ' ILE . 2.7 m-70 -55.01 -47.8 74.2 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.116 -0.99 . . . . 0.0 110.066 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mp -66.0 -38.89 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.238 -0.914 . . . . 0.0 109.197 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.26 79.21 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.186 -0.946 . . . . 0.0 109.696 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.8 -36.97 85.01 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.168 -0.958 . . . . 0.0 109.903 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.2 tp -82.31 -30.9 30.24 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.066 -1.021 . . . . 0.0 110.646 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.8 t -101.26 55.78 0.84 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.869 -1.145 . . . . 0.0 110.263 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 p . . . . . 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.015 . . . . 0.0 110.247 179.779 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.76 126.18 51.98 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.233 -0.917 . . . . 0.0 110.177 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.45 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 1.5 m-85 -116.18 143.95 44.82 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.171 -0.956 . . . . 0.0 110.059 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.5 p -141.03 138.32 33.58 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.237 -0.914 . . . . 0.0 109.877 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.4 ' CG1' ' CD2' ' A' ' 76' ' ' LEU . 21.7 m -104.53 140.5 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.093 -1.004 . . . . 0.0 110.222 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -142.28 156.05 45.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.245 -0.909 . . . . 0.0 110.335 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -107.35 154.07 21.83 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.359 -0.838 . . . . 0.0 109.792 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.33 142.27 32.18 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.243 -0.911 . . . . 0.0 110.058 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -143.51 -59.86 0.41 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.292 -0.88 . . . . 0.0 110.163 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.62 84.57 2.25 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.251 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.34 174.82 14.51 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 55.3 p -140.68 139.18 34.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.184 -1.186 . . . . 0.0 110.204 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -123.42 150.77 43.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.214 -0.929 . . . . 0.0 110.677 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.08 120.13 5.22 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.6 t -64.71 122.52 17.07 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.262 -1.14 . . . . 0.0 109.732 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.83 148.05 44.52 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.057 -1.027 . . . . 0.0 108.669 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp 53.0 64.93 1.67 Allowed 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.906 -1.121 . . . . 0.0 108.949 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -172.94 -43.65 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.221 -0.924 . . . . 0.0 112.555 -177.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tttm 70.06 44.85 0.75 Allowed 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.884 -1.135 . . . . 0.0 108.202 -177.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.72 -168.38 2.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.556 -0.715 . . . . 0.0 109.49 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -137.22 157.5 46.52 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.984 -1.073 . . . . 0.0 110.42 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 69.5 mt -110.95 110.28 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.402 -0.811 . . . . 0.0 109.826 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.4 m -110.11 169.39 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 O-C-N 121.187 -0.946 . . . . 0.0 110.614 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.8 tttt -46.6 138.61 5.8 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 121.56 -0.712 . . . . 0.0 111.136 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 107.57 -23.16 27.02 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.968 -1.11 . . . . 0.0 110.533 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.8 p -113.52 137.59 46.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-N 119.151 1.475 . . . . 0.0 110.318 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.8 t -91.17 142.43 27.75 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.045 -1.035 . . . . 0.0 110.199 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.431 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 1.1 ptt180 -128.16 153.3 47.03 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.143 -0.973 . . . . 0.0 110.533 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.4 mt -111.95 137.26 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.344 -0.847 . . . . 0.0 110.414 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.414 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.09 129.2 9.58 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 108.348 -1.901 . . . . 0.0 108.348 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.45 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 33.6 ttpt -110.15 116.96 32.47 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.069 -1.253 . . . . 0.0 110.395 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.6 t -109.24 109.4 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.222 -0.924 . . . . 0.0 110.017 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.3 t -120.53 112.57 34.03 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.215 -0.928 . . . . 0.0 109.961 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.3 133.75 19.82 Favored 'Trans proline' 0 C--N 1.32 -0.941 0 O-C-N 123.119 1.063 . . . . 0.0 110.393 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 61.1 t30 . . . . . 0 N--CA 1.5 2.049 0 O-C-N 121.203 -0.935 . . . . 0.0 110.028 179.719 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.48 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -133.33 147.41 51.84 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.167 -1.196 . . . . 0.0 110.331 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.7 mtt -115.27 143.58 45.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.167 -0.958 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -118.6 123.88 46.08 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.225 -0.922 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -116.66 137.21 52.36 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.181 -0.949 . . . . 0.0 109.897 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 26.7 m95 -92.84 134.48 35.04 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.219 -0.925 . . . . 0.0 109.998 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -121.71 176.01 5.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.255 -0.903 . . . . 0.0 110.739 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -96.69 -172.36 2.47 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 178.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.496 HG23 ' NE2' ' A' ' 93' ' ' HIS . 39.8 mm -84.74 -37.14 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.998 -1.064 . . . . 0.0 109.275 178.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.45 -27.26 20.49 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.74 -1.225 . . . . 0.0 111.213 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 83.3 m -70.46 -46.49 63.7 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.819 -1.176 . . . . 0.0 110.435 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -68.8 -38.52 80.0 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.323 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.429 ' CE1' HG13 ' A' ' 94' ' ' ILE . 9.3 m-85 -75.05 -31.43 61.3 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.803 -1.159 . . . . 0.0 109.578 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -62.51 -36.21 81.82 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.026 -1.047 . . . . 0.0 109.524 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -60.24 -40.16 89.28 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.093 -1.005 . . . . 0.0 109.758 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -60.96 -42.33 98.08 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.975 . . . . 0.0 109.154 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -56.08 -33.68 65.27 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.205 -0.935 . . . . 0.0 109.674 178.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 33.4 mtm-85 -102.63 29.59 5.21 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.279 -0.888 . . . . 0.0 110.449 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.808 0 O-C-N 120.905 -1.122 . . . . 0.0 109.902 179.742 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.3 mtmt . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 120.699 0.285 . . . . 0.0 110.402 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.2 mt 54.77 101.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.2 -0.937 . . . . 0.0 110.821 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -110.92 143.32 41.73 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.068 -1.02 . . . . 0.0 109.892 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.58 -170.75 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.039 -1.038 . . . . 0.0 110.477 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tp -111.37 43.4 1.5 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.146 -0.971 . . . . 0.0 110.105 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.9 -168.9 3.24 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.141 -0.974 . . . . 0.0 110.051 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 55.42 38.11 29.83 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.905 -1.122 . . . . 0.0 109.935 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.4 ' CD2' ' CG1' ' A' ' 8' ' ' VAL . 1.5 tp -144.65 150.44 37.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.348 -0.845 . . . . 0.0 109.48 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -93.78 104.45 16.53 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.061 -1.024 . . . . 0.0 110.464 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.02 -45.26 0.68 Allowed Glycine 0 N--CA 1.494 2.514 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.762 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 34.0 p-90 -58.72 -35.51 72.79 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.004 -1.292 . . . . 0.0 110.614 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -56.17 -34.4 66.14 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.921 -1.112 . . . . 0.0 110.699 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -83.58 -34.87 25.08 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.953 -1.092 . . . . 0.0 110.722 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.77 175.1 0.01 OUTLIER 'General case' 0 N--CA 1.518 2.93 0 O-C-N 121.067 -1.02 . . . . 0.0 110.941 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.76 161.61 13.53 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.312 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.59 -45.3 89.41 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.976 . . . . 0.0 110.41 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -61.52 -51.75 67.32 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.533 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.65 -39.33 94.09 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.111 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -59.96 -38.75 83.39 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.305 -0.872 . . . . 0.0 109.709 179.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -60.32 -39.35 86.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.15 -0.969 . . . . 0.0 109.861 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.84 -40.95 90.25 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.14 -0.975 . . . . 0.0 110.1 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.4 mt -62.28 -40.19 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 O-C-N 121.205 -0.934 . . . . 0.0 109.524 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.9 m -58.15 -39.62 79.25 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.04 -1.037 . . . . 0.0 109.921 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.8 -39.27 80.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.227 -0.92 . . . . 0.0 109.627 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.496 ' NE2' HG23 ' A' ' 53' ' ' ILE . 7.3 m-70 -60.01 -52.04 67.08 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.253 -0.904 . . . . 0.0 109.778 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.429 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.6 mt -62.68 -39.08 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.383 -0.927 . . . . 0.0 109.444 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.72 94.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.187 -0.946 . . . . 0.0 109.47 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.7 -39.7 66.78 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.229 -0.919 . . . . 0.0 109.11 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 21.6 tp -68.5 -32.58 72.66 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.267 -0.896 . . . . 0.0 110.363 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 16.3 t -92.81 -40.63 10.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.925 -1.109 . . . . 0.0 110.177 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.143 -0.973 . . . . 0.0 110.147 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.184 0 CA-C-O 120.948 0.404 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -124.01 129.98 51.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.147 -0.971 . . . . 0.0 110.167 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.416 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.4 m-85 -124.02 137.44 54.59 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.158 -0.964 . . . . 0.0 110.086 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.2 t -126.77 147.87 49.96 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 109.628 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.404 ' CG1' ' CD2' ' A' ' 76' ' ' LEU . 27.2 m -116.18 139.63 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 121.057 -1.027 . . . . 0.0 110.604 179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -147.5 162.73 38.47 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.24 -0.913 . . . . 0.0 110.399 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.428 ' OH ' ' HB3' ' A' ' 86' ' ' GLU . 0.6 OUTLIER -110.29 141.55 43.12 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.368 -0.832 . . . . 0.0 109.814 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.93 134.06 54.4 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.744 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -140.62 -65.68 0.45 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.209 -0.932 . . . . 0.0 110.465 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -121.97 85.33 2.39 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.176 -0.953 . . . . 0.0 110.228 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 126.92 159.36 10.16 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -132.48 149.64 52.3 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.212 -1.169 . . . . 0.0 110.086 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.06 145.85 50.58 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.168 -0.958 . . . . 0.0 110.557 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.43 118.63 7.97 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.9 t -63.85 123.28 18.52 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.191 -1.182 . . . . 0.0 109.695 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.61 147.86 44.33 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.08 -1.013 . . . . 0.0 108.664 179.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt 53.09 64.66 1.78 Allowed 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.979 -1.076 . . . . 0.0 108.815 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -173.04 -43.58 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.249 -0.907 . . . . 0.0 112.583 -177.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt 69.06 44.15 1.04 Allowed 'General case' 0 N--CA 1.505 2.295 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -177.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 -168.71 2.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.564 -0.71 . . . . 0.0 109.437 -179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -140.1 158.67 43.69 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.017 -1.052 . . . . 0.0 110.193 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.8 mt -102.89 118.12 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.505 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.3 t -107.76 160.25 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.162 -0.961 . . . . 0.0 110.352 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -48.49 121.7 4.74 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 121.444 -0.785 . . . . 0.0 111.15 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.68 -25.93 5.24 Favored Glycine 0 N--CA 1.493 2.448 0 C-N-CA 119.999 -1.096 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.6 m -104.38 137.61 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 CA-C-N 119.148 1.474 . . . . 0.0 110.488 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 1.3 t -81.06 134.99 35.76 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.192 -0.942 . . . . 0.0 109.647 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.422 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 12.0 ptt-85 -122.43 149.03 44.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.201 -0.937 . . . . 0.0 110.402 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.426 HG23 HD11 ' A' ' 32' ' ' ILE . 13.1 mt -108.35 139.87 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.315 -0.865 . . . . 0.0 110.603 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.03 122.38 6.9 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 41.0 tttt -105.97 120.07 40.83 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.101 -1.235 . . . . 0.0 110.082 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.402 ' CG1' ' CB ' ' A' ' 46' ' ' ASP . 62.1 t -103.5 107.17 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.25 -0.906 . . . . 0.0 110.22 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.7 t -122.31 138.31 28.89 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 109.615 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.92 131.89 16.24 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.262 1.138 . . . . 0.0 110.22 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 . . . . . 0 N--CA 1.499 1.999 0 O-C-N 121.102 -0.999 . . . . 0.0 110.166 179.883 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.402 ' CB ' ' CG1' ' A' ' 35' ' ' VAL . 0.9 OUTLIER -116.74 158.09 24.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.166 -1.196 . . . . 0.0 110.245 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttt -101.72 144.16 30.76 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.363 -0.836 . . . . 0.0 110.119 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.425 ' HE3' ' CZ2' ' A' ' 50' ' ' TRP . 26.9 ttpt -116.53 123.01 46.37 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.327 -0.858 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -115.26 140.36 49.17 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.346 -0.846 . . . . 0.0 109.712 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.452 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 57.0 m95 -97.83 128.14 44.26 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.137 -0.977 . . . . 0.0 110.167 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -115.81 174.64 5.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.344 -0.847 . . . . 0.0 110.855 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -91.28 -171.43 2.95 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.465 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 46.6 mm -83.49 -39.9 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.879 -1.138 . . . . 0.0 109.722 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -85.06 -32.26 22.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 120.83 -1.169 . . . . 0.0 111.058 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 71.2 m -62.68 -52.89 61.51 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.994 -1.066 . . . . 0.0 110.4 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -40.39 88.02 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.012 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.502 ' CG ' ' NE2' ' A' ' 93' ' ' HIS . 9.6 m-85 -70.97 -30.43 66.7 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 119.08 -1.048 . . . . 0.0 109.634 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -61.35 -36.86 81.35 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.598 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.14 88.58 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.024 -1.048 . . . . 0.0 109.804 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.05 -44.42 95.92 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.429 -0.909 . . . . 0.0 108.969 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.38 -33.62 68.01 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.218 -0.926 . . . . 0.0 109.695 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.65 29.33 5.82 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.277 -0.889 . . . . 0.0 110.576 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.753 0 O-C-N 120.888 -1.133 . . . . 0.0 110.042 179.841 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp . . . . . 0 N--CA 1.494 1.771 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.461 HG22 HD11 ' A' ' 70' ' ' ILE . 77.4 mt 54.54 99.34 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.213 -0.929 . . . . 0.0 110.704 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -112.7 135.25 53.66 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 0.0 109.978 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.0 -173.52 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.039 -1.038 . . . . 0.0 110.547 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 49.8 tp -113.71 83.26 1.82 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.162 -0.961 . . . . 0.0 110.22 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.0 -51.62 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.161 -0.962 . . . . 0.0 111.056 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -49.38 -36.32 21.43 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.113 -0.992 . . . . 0.0 110.796 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.404 ' CD2' ' CG1' ' A' ' 8' ' ' VAL . 6.3 mp -72.74 150.43 42.87 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.189 -0.944 . . . . 0.0 109.367 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -97.77 136.74 37.68 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.249 -0.907 . . . . 0.0 111.251 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.53 -41.63 1.52 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.46 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 52.9 p-90 -53.96 -35.65 62.01 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.993 -1.298 . . . . 0.0 110.868 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.46 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 15.8 tt0 -68.11 -28.93 67.76 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.111 -0.993 . . . . 0.0 111.035 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -96.38 -34.52 11.51 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 120.826 -1.171 . . . . 0.0 111.251 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.4 HD11 ' CD2' ' A' ' 10' ' ' TYR . 74.4 mt -59.25 -175.3 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.865 -1.147 . . . . 0.0 110.151 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.33 161.63 11.21 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.154 -0.966 . . . . 0.0 110.26 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.2 -45.43 11.33 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.217 -0.927 . . . . 0.0 109.925 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -62.6 -42.45 99.58 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.315 -0.866 . . . . 0.0 109.396 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.428 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 1.1 mp0 -61.57 -40.28 94.16 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.338 -0.851 . . . . 0.0 109.514 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -57.66 -39.57 77.33 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.322 -0.861 . . . . 0.0 109.943 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -60.41 -42.23 95.53 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.206 -0.933 . . . . 0.0 109.637 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -59.81 -35.37 74.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.324 -0.86 . . . . 0.0 110.237 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.9 mm -60.33 -38.93 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.492 0 O-C-N 121.109 -0.994 . . . . 0.0 109.634 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 m -58.59 -42.53 88.29 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.02 -1.05 . . . . 0.0 109.795 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -63.35 -40.64 97.84 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.297 -0.877 . . . . 0.0 109.284 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.502 ' NE2' ' CG ' ' A' ' 57' ' ' PHE . 67.6 t60 -58.39 -41.8 85.7 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.192 -0.942 . . . . 0.0 109.59 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.441 ' CG1' ' CZ ' ' A' ' 57' ' ' PHE . 9.3 mt -69.75 -39.62 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.176 -0.952 . . . . 0.0 108.9 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.89 -38.05 84.32 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.211 -0.931 . . . . 0.0 109.728 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -63.62 -41.48 98.27 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.134 -0.978 . . . . 0.0 109.488 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.9 tp -60.7 -35.58 76.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.243 -0.911 . . . . 0.0 110.33 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.1 t -89.93 -39.29 13.1 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.05 -1.031 . . . . 0.0 110.178 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.495 1.8 0 O-C-N 121.183 -0.948 . . . . 0.0 110.099 179.868 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -141.47 125.43 17.17 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.915 . . . . 0.0 110.288 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.443 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 0.9 OUTLIER -117.05 141.56 48.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.17 -0.956 . . . . 0.0 110.052 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.5 m -127.74 156.39 42.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 109.803 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 59.6 t -111.2 120.58 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.128 -0.982 . . . . 0.0 109.927 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -137.95 156.45 47.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.136 -0.978 . . . . 0.0 110.605 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -101.45 154.1 19.11 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.485 -0.76 . . . . 0.0 109.693 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.27 140.76 29.38 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.246 -0.909 . . . . 0.0 110.34 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 tttp -136.03 -58.11 0.76 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.279 -0.888 . . . . 0.0 110.456 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -134.34 99.14 4.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.075 . . . . 0.0 110.316 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.6 138.65 3.35 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.6 p -124.54 146.35 49.06 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.189 -1.183 . . . . 0.0 109.942 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -163.35 153.93 16.16 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.18 -0.95 . . . . 0.0 111.435 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.77 120.13 8.66 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 24.5 p -58.92 140.29 55.64 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.184 -1.186 . . . . 0.0 110.21 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 8.0 tptt -94.19 150.73 20.04 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.114 -0.991 . . . . 0.0 110.581 -178.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 13.2 mptt 51.6 48.39 22.97 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.448 ' SG ' ' SG ' ' A' ' 55' ' ' CYS 0.263 10.4 t -165.2 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.861 -0.524 . . . . 0.0 110.485 -175.481 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 21' ' ' CYS . 23.5 tttt 78.12 74.22 0.06 Allowed 'General case' 0 N--CA 1.526 3.342 0 O-C-N 120.947 -1.096 . . . . 0.0 112.492 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.404 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.4 tt0 -176.11 -172.88 0.53 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.165 -0.959 . . . . 0.0 110.604 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -120.3 146.16 46.38 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.112 -0.992 . . . . 0.0 109.142 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.9 mt -107.11 141.82 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.058 -1.026 . . . . 0.0 110.477 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.4 t -141.12 158.04 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.249 -0.907 . . . . 0.0 109.961 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.54 135.97 17.43 Favored 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.287 -0.883 . . . . 0.0 111.089 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.56 8.72 39.81 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.155 -1.021 . . . . 0.0 111.828 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.45 132.79 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-N 119.853 1.827 . . . . 0.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 20.2 t -73.19 143.3 47.25 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.22 -0.925 . . . . 0.0 108.855 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.422 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 11.9 ptt180 -145.47 155.38 43.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.123 -0.986 . . . . 0.0 111.475 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.8 mt -105.08 145.09 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.449 -0.782 . . . . 0.0 109.848 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.83 137.69 13.91 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 108.413 -1.875 . . . . 0.0 108.413 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.443 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 19.4 ttpt -117.94 123.75 46.55 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.903 -1.351 . . . . 0.0 110.42 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -96.44 113.09 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.229 -0.919 . . . . 0.0 110.115 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.9 t -120.49 119.13 30.6 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.267 -0.896 . . . . 0.0 109.916 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.35 145.66 38.73 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 O-C-N 123.132 1.07 . . . . 0.0 110.342 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.7 t30 . . . . . 0 N--CA 1.5 2.039 0 O-C-N 121.149 -0.97 . . . . 0.0 110.151 179.874 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.436 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -144.22 136.61 26.66 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -1.207 . . . . 0.0 110.268 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ttt -117.04 142.95 46.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.275 -0.891 . . . . 0.0 110.34 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -125.25 120.74 32.09 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.278 -0.889 . . . . 0.0 110.26 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -117.98 149.46 40.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.254 -0.904 . . . . 0.0 109.221 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.422 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 16.9 m95 -91.62 163.2 14.2 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.105 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.432 ' OH ' ' HB2' ' A' ' 20' ' ' LYS . 34.0 m-85 -140.39 173.91 11.04 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.38 -0.825 . . . . 0.0 110.841 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.427 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 11.1 m80 -108.77 -176.92 3.17 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.361 -0.837 . . . . 0.0 109.52 177.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 48.7 mm -97.48 -60.45 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -80.1 -43.14 22.25 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.782 -1.199 . . . . 0.0 109.388 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.448 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 19.3 t -63.12 -27.99 69.76 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.71 178.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -83.2 -54.34 5.09 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.725 -1.234 . . . . 0.0 108.648 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.471 ' CD1' ' CD2' ' A' ' 93' ' ' HIS . 13.0 m-85 -59.61 -26.55 65.56 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.72 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.71 -38.98 86.89 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.833 -1.167 . . . . 0.0 109.375 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.5 tttm -67.96 -40.65 83.17 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.281 178.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.75 -41.76 96.06 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.239 -0.913 . . . . 0.0 109.081 179.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -56.17 -33.41 65.22 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.245 -0.909 . . . . 0.0 109.695 178.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.3 mtp-105 -103.68 29.87 5.46 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.316 -0.865 . . . . 0.0 110.573 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.84 0 O-C-N 120.948 -1.095 . . . . 0.0 110.026 179.852 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.7 mtpt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 110.183 -0.302 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.3 97.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.174 -0.953 . . . . 0.0 110.642 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -114.79 136.2 53.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.147 -0.97 . . . . 0.0 110.333 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.67 -178.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.043 -1.036 . . . . 0.0 110.919 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 62.3 tp -114.4 81.22 1.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.291 -0.881 . . . . 0.0 110.374 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -172.17 -51.63 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 110.722 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -51.19 -36.77 43.0 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.11 -0.994 . . . . 0.0 110.425 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 mp -63.46 152.33 38.68 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.136 -0.978 . . . . 0.0 109.451 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -102.1 116.29 32.36 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.187 -0.946 . . . . 0.0 110.307 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.08 -36.12 1.77 Allowed Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.909 -1.139 . . . . 0.0 110.467 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -51.53 -32.24 27.12 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.894 -1.357 . . . . 0.0 111.021 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -56.7 -39.87 74.63 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.907 -1.121 . . . . 0.0 110.126 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.61 -41.16 93.04 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.169 -0.957 . . . . 0.0 109.629 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.8 mp -47.67 165.55 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.913 0 O-C-N 121.291 -0.881 . . . . 0.0 110.875 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -88.47 161.37 17.05 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.226 -0.921 . . . . 0.0 109.823 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -56.32 -38.27 71.09 Favored 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.15 -0.968 . . . . 0.0 110.687 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -71.89 -40.42 68.91 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.182 -0.949 . . . . 0.0 109.707 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.409 ' OE2' ' OH ' ' A' ' 10' ' ' TYR . 6.1 mm-40 -73.4 -36.16 65.97 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.222 -0.924 . . . . 0.0 109.346 178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -69.56 -37.67 77.12 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.117 -0.989 . . . . 0.0 109.625 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.402 ' O ' ' OG1' ' A' ' 91' ' ' THR . 31.8 tt0 -64.55 -39.49 93.85 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.211 -0.931 . . . . 0.0 109.667 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -59.82 -34.03 72.53 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.423 HG22 HD11 ' A' ' 90' ' ' ILE . 96.5 mt -65.01 -39.92 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.02 -1.05 . . . . 0.0 109.571 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 73.8 p -61.82 -46.76 88.09 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.063 -1.023 . . . . 0.0 109.354 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -61.66 -38.96 89.69 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.267 -0.896 . . . . 0.0 108.897 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.471 ' CD2' ' CD1' ' A' ' 57' ' ' PHE . 42.1 t60 -57.22 -48.82 77.83 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.238 -0.914 . . . . 0.0 109.737 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.0 mt -69.49 -39.97 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.648 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.73 -35.98 81.51 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.683 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.31 -37.6 85.78 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.3 tp -74.93 -40.52 60.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.114 -0.991 . . . . 0.0 110.032 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.0 t -60.99 -44.0 98.04 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.219 -0.926 . . . . 0.0 109.882 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.494 1.764 0 O-C-N 121.252 -0.905 . . . . 0.0 110.272 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 120.734 0.302 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 -136.73 149.67 47.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.153 -0.967 . . . . 0.0 110.143 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.507 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 1.7 m-85 -120.55 149.82 41.83 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.268 -0.895 . . . . 0.0 110.472 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.0 t -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.251 -0.906 . . . . 0.0 109.666 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 20.0 m -102.79 106.21 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.143 -0.973 . . . . 0.0 110.671 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -118.26 158.95 24.21 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.917 -1.115 . . . . 0.0 110.476 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.428 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -101.69 144.4 30.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.49 -0.756 . . . . 0.0 109.819 179.797 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.95 102.04 0.14 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.245 -0.91 . . . . 0.0 109.879 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -123.42 110.81 15.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 0.0 110.167 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 52.94 88.51 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.06 -1.025 . . . . 0.0 110.708 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.16 131.36 2.76 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 69.1 p -129.86 140.63 50.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -1.175 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -159.01 148.6 18.93 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.168 -0.957 . . . . 0.0 111.477 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.0 126.26 38.08 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 21.1 p -64.25 126.33 27.41 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.261 -1.14 . . . . 0.0 110.837 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 17.3 mttm -75.59 156.71 34.7 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.87 15.07 10.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.974 -1.079 . . . . 0.0 111.492 -178.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.831 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.2 p -175.51 151.44 1.21 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.555 -1.341 . . . . 0.0 110.602 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.63 90.48 8.27 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.989 -1.069 . . . . 0.0 111.731 -177.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.412 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.3 tt0 -168.88 -175.13 2.27 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.257 -0.902 . . . . 0.0 110.64 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.34 153.59 46.87 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.082 -1.011 . . . . 0.0 109.395 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.5 mt -106.28 111.29 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.218 -0.926 . . . . 0.0 110.111 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.5 t -114.19 158.92 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.012 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.08 133.22 23.28 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.245 -0.909 . . . . 0.0 111.0 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 105.17 6.12 39.72 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 120.163 -1.017 . . . . 0.0 111.754 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.9 p -127.05 135.86 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 119.77 1.785 . . . . 0.0 110.476 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.428 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 8.2 t -87.72 140.61 29.34 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.115 -0.99 . . . . 0.0 109.975 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 ptt-85 -135.07 144.31 47.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.198 -0.939 . . . . 0.0 110.324 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.417 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 19.0 mt -108.82 122.56 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 109.351 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.18 162.44 15.24 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.46 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 12.3 pttp -127.86 140.9 51.74 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.277 -1.131 . . . . 0.0 109.405 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.2 t -109.34 109.18 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.972 -1.08 . . . . 0.0 110.14 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.2 t -121.12 112.62 33.12 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.211 -0.93 . . . . 0.0 109.915 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.96 137.15 26.19 Favored 'Trans proline' 0 N--CA 1.486 1.059 0 O-C-N 123.118 1.062 . . . . 0.0 110.356 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 . . . . . 0 N--CA 1.5 2.036 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.813 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.456 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -126.96 149.62 49.76 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.114 -1.227 . . . . 0.0 110.36 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.9 mtt -113.81 135.4 54.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.273 -0.892 . . . . 0.0 110.123 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 22.3 ttmt -121.75 135.37 54.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.17 -0.956 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -113.09 145.25 41.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.163 -0.96 . . . . 0.0 109.598 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.409 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 11.9 m95 -104.14 112.24 25.16 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.052 -1.03 . . . . 0.0 111.074 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -124.13 173.68 8.14 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.399 176.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.8 m80 -93.41 177.66 5.96 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.475 -0.766 . . . . 0.0 110.693 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.415 HG22 ' CE2' ' A' ' 57' ' ' PHE . 30.3 mt -77.24 -54.83 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -57.46 -38.03 73.82 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.032 -1.042 . . . . 0.0 109.695 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 18.8 m -62.3 -50.15 72.79 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.133 -0.979 . . . . 0.0 109.085 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -44.83 67.09 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.388 -0.82 . . . . 0.0 109.522 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.415 ' CE2' HG22 ' A' ' 53' ' ' ILE . 11.4 m-85 -64.47 -29.52 70.56 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.613 179.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -62.21 -42.05 98.94 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.854 -1.154 . . . . 0.0 109.091 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.4 -40.84 73.68 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.734 178.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -41.88 94.88 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.262 -0.899 . . . . 0.0 108.882 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -60.11 -35.09 74.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.474 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.72 31.56 5.18 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.264 -0.897 . . . . 0.0 110.558 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.954 0 O-C-N 120.85 -1.156 . . . . 0.0 110.1 179.871 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 120.766 0.317 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.2 mt 54.86 101.02 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.172 -0.955 . . . . 0.0 110.782 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.23 135.6 44.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.144 -0.973 . . . . 0.0 109.452 179.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 54.64 -162.75 0.13 Allowed 'General case' 0 N--CA 1.502 2.138 0 O-C-N 120.944 -1.098 . . . . 0.0 109.977 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.462 ' CD1' ' OG1' ' A' ' 91' ' ' THR . 0.7 OUTLIER -132.48 39.08 3.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.022 -1.049 . . . . 0.0 110.602 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.03 35.87 0.84 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.206 -0.934 . . . . 0.0 110.481 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -133.65 37.26 3.3 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.099 -1.001 . . . . 0.0 109.923 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.409 ' O ' ' CD1' ' A' ' 79' ' ' TRP . 96.5 mt -136.35 152.73 50.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.228 -0.92 . . . . 0.0 109.75 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -81.16 110.31 16.54 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.069 -1.019 . . . . 0.0 110.097 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.31 -34.75 1.61 Allowed Glycine 0 N--CA 1.494 2.544 0 C-N-CA 119.691 -1.242 . . . . 0.0 111.073 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.412 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 20.2 p-90 -63.95 -31.11 72.18 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.12 1.46 . . . . 0.0 110.759 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.412 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.0 tt0 -52.88 -35.17 57.52 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.829 -1.17 . . . . 0.0 110.596 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -82.64 -33.37 27.87 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.031 -1.043 . . . . 0.0 110.291 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.408 HD12 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -51.26 176.68 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.872 0 O-C-N 120.916 -1.115 . . . . 0.0 110.555 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -104.22 160.83 14.55 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.123 -0.986 . . . . 0.0 110.416 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.94 -43.33 95.06 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.197 -0.939 . . . . 0.0 110.313 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -61.62 -50.76 71.28 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.701 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.25 -38.59 89.84 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.481 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? -60.52 -38.66 85.11 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.219 -0.926 . . . . 0.0 109.727 179.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -57.64 -38.19 74.63 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.195 -0.941 . . . . 0.0 110.049 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.26 -38.32 76.68 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.086 -1.009 . . . . 0.0 110.255 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.3 mt -64.66 -39.34 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 121.047 -1.033 . . . . 0.0 109.352 179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.462 ' OG1' ' CD1' ' A' ' 73' ' ' LEU . 33.6 m -57.35 -39.54 76.14 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -56.86 -39.11 73.7 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.206 -0.934 . . . . 0.0 109.837 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -61.9 -54.27 44.33 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.235 -0.916 . . . . 0.0 109.642 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -62.77 -38.38 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.273 -0.971 . . . . 0.0 109.218 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -38.48 89.02 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.241 -0.912 . . . . 0.0 109.766 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -60.77 -46.67 89.56 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 109.541 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.7 mp -59.25 -35.12 73.12 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.271 -0.893 . . . . 0.0 110.014 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.0 m -102.41 69.64 1.12 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.16 -0.963 . . . . 0.0 110.169 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.0 t . . . . . 0 N--CA 1.499 1.983 0 O-C-N 121.094 -1.004 . . . . 0.0 110.04 179.703 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 N--CA 1.493 1.687 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -139.38 139.14 37.09 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.17 -0.956 . . . . 0.0 110.337 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.51 ' CE2' ' OH ' ' A' ' 51' ' ' TYR . 2.0 m-85 -115.98 146.63 41.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.254 -0.904 . . . . 0.0 109.999 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.4 m -130.16 159.59 36.36 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.218 -0.926 . . . . 0.0 109.189 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 22.8 m -125.69 105.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.019 -1.051 . . . . 0.0 111.061 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -100.44 141.74 32.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.949 -1.095 . . . . 0.0 109.576 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.437 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 46.8 m-85 -103.99 133.57 48.72 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.22 -0.925 . . . . 0.0 109.721 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.14 133.41 54.99 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -118.25 -58.28 2.0 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -153.68 39.23 0.48 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.168 -0.958 . . . . 0.0 110.642 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -139.25 171.63 23.59 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 m -145.08 127.25 15.69 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.198 -1.177 . . . . 0.0 110.476 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -149.17 143.83 26.2 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.206 -0.934 . . . . 0.0 110.813 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.19 128.0 44.78 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 108.749 -1.74 . . . . 0.0 108.749 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.904 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 32.0 p -64.35 122.55 16.96 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.222 -1.163 . . . . 0.0 110.811 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -68.34 157.25 36.09 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.349 -0.844 . . . . 0.0 108.838 179.69 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 15.79 10.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.842 -1.161 . . . . 0.0 111.83 -179.035 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.904 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.9 p -175.29 150.09 1.11 Allowed 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.566 -1.334 . . . . 0.0 110.699 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -86.85 89.13 7.86 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.008 -1.058 . . . . 0.0 111.784 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -165.66 -173.34 2.7 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.308 -0.87 . . . . 0.0 110.409 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -130.32 149.75 51.87 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.014 -1.054 . . . . 0.0 109.499 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.5 mt -102.7 134.35 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.263 -0.898 . . . . 0.0 110.006 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.9 m -136.6 169.2 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.267 -0.896 . . . . 0.0 110.322 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.19 127.33 10.44 Favored 'General case' 0 N--CA 1.516 2.857 0 O-C-N 121.583 -0.698 . . . . 0.0 110.948 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.53 8.81 48.58 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.097 -1.049 . . . . 0.0 111.156 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.1 t -111.2 135.65 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.547 1.673 . . . . 0.0 110.014 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.7 t -91.44 123.06 34.58 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.302 -0.874 . . . . 0.0 108.679 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.95 133.82 51.03 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.16 -0.963 . . . . 0.0 110.652 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.405 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 6.2 mt -106.47 113.1 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.02 135.54 12.2 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 119.723 -1.227 . . . . 0.0 110.361 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 6' ' ' PHE . 3.4 ttpm? -111.99 123.93 51.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -1.07 . . . . 0.0 108.986 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.2 t -109.29 108.99 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.132 -0.98 . . . . 0.0 110.272 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 33.2 m -123.6 146.94 51.59 Favored Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.215 -0.928 . . . . 0.0 110.24 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.87 146.25 33.0 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.393 1.207 . . . . 0.0 110.173 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.2 t30 . . . . . 0 N--CA 1.499 1.996 0 O-C-N 121.176 -0.953 . . . . 0.0 110.227 179.735 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.479 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -129.36 144.79 51.38 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.23 -1.159 . . . . 0.0 110.112 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 tpt -117.9 146.22 44.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.167 -0.958 . . . . 0.0 110.766 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -131.87 144.78 51.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.24 -0.913 . . . . 0.0 109.671 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -135.56 145.37 46.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.037 -1.04 . . . . 0.0 110.45 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -97.85 115.86 28.91 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.166 -0.959 . . . . 0.0 110.53 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.51 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.8 171.36 11.29 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.073 -1.017 . . . . 0.0 109.989 177.859 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.445 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 63.0 m80 -88.44 163.04 16.16 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.418 HG23 ' CD2' ' A' ' 93' ' ' HIS . 33.4 mt -67.6 -48.12 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -61.14 -40.75 95.0 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.163 -0.961 . . . . 0.0 109.334 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 35.6 m -64.1 -44.64 91.7 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.268 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.5 ttp -72.44 -43.26 64.03 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.429 -0.795 . . . . 0.0 109.993 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -71.86 -29.75 64.7 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.794 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -78.5 -39.5 38.04 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 120.787 -1.195 . . . . 0.0 109.244 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -73.2 -35.78 66.41 Favored 'General case' 0 N--CA 1.505 2.28 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.367 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 tp -73.37 -40.03 64.69 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.229 -0.919 . . . . 0.0 109.409 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -69.85 -27.46 64.86 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.061 -1.025 . . . . 0.0 110.349 179.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.22 -36.3 10.08 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.917 -1.114 . . . . 0.0 110.966 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.858 0 O-C-N 120.956 -1.09 . . . . 0.0 111.075 -179.412 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 30.1 tttp . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 120.66 0.267 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.0 mt -114.59 99.01 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.237 -0.914 . . . . 0.0 109.814 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -108.84 132.91 53.56 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.293 -0.879 . . . . 0.0 109.801 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 51.24 -165.37 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.094 -1.004 . . . . 0.0 110.493 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 54.0 tp -122.0 84.22 2.22 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.102 -0.999 . . . . 0.0 110.032 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -155.72 -54.85 0.09 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.236 -0.915 . . . . 0.0 110.964 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -47.73 -32.71 6.13 Favored 'General case' 0 N--CA 1.518 2.948 0 O-C-N 121.074 -1.016 . . . . 0.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.4 mp -72.69 153.18 41.31 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.054 -1.029 . . . . 0.0 110.218 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -99.65 136.46 39.55 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.266 -0.896 . . . . 0.0 110.697 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.33 -35.07 2.66 Favored Glycine 0 N--CA 1.494 2.563 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 44.3 p-90 -67.29 -15.36 63.65 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 120.923 -1.34 . . . . 0.0 112.123 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -51.19 -37.67 47.94 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.556 -1.34 . . . . 0.0 111.356 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -169.3 54.89 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 120.979 -1.076 . . . . 0.0 112.071 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 14.0 mt -111.4 -70.36 0.82 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 109.926 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -122.49 131.17 53.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.072 -1.017 . . . . 0.0 110.133 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -88.16 -50.68 6.22 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.081 -1.012 . . . . 0.0 109.966 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -66.55 -41.74 88.19 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.971 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.381 178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.1 tttt -58.09 -38.93 77.35 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.117 -0.989 . . . . 0.0 109.879 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 2.8 tm-20 -60.93 -40.34 92.85 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.244 -0.91 . . . . 0.0 109.794 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.77 92.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.13 -0.981 . . . . 0.0 110.101 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.3 mt -62.19 -40.42 87.55 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 121.191 -0.943 . . . . 0.0 109.746 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 67.3 p -61.51 -39.13 89.87 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.123 -0.986 . . . . 0.0 109.94 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -58.88 -39.87 82.67 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.179 -0.951 . . . . 0.0 109.962 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.418 ' CD2' HG23 ' A' ' 53' ' ' ILE . 7.8 m-70 -58.6 -46.15 87.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.171 -0.956 . . . . 0.0 110.163 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.0 mp -61.96 -41.56 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.169 -0.957 . . . . 0.0 108.927 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.34 83.04 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.499 -0.881 . . . . 0.0 109.926 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -71.6 -38.31 70.86 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.136 -0.978 . . . . 0.0 109.81 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 38.0 tp -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.123 -0.985 . . . . 0.0 110.598 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 39.5 t -91.89 -40.68 11.03 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.973 -1.079 . . . . 0.0 110.034 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.186 -0.946 . . . . 0.0 110.115 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 . . . . . 0 N--CA 1.494 1.731 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -142.36 145.79 34.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.218 -0.926 . . . . 0.0 110.381 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.529 ' CE2' ' OH ' ' A' ' 51' ' ' TYR . 1.7 m-85 -116.69 147.04 42.34 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.193 -0.942 . . . . 0.0 110.202 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.8 t -128.01 148.24 50.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.329 -0.857 . . . . 0.0 108.884 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.9 m -128.82 109.47 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.063 -1.023 . . . . 0.0 110.824 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -123.47 161.46 24.81 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.11 -0.994 . . . . 0.0 110.69 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.429 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -102.39 155.64 18.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.495 -0.753 . . . . 0.0 110.072 179.901 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.33 140.01 30.35 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.357 -0.839 . . . . 0.0 110.019 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.3 mttm -114.88 -62.36 1.61 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.149 -0.97 . . . . 0.0 110.269 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -139.35 39.61 2.08 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.255 -0.903 . . . . 0.0 110.335 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.25 124.7 2.59 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.3 p -113.75 146.03 40.49 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.198 -1.178 . . . . 0.0 110.163 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -158.15 147.87 19.85 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.227 -0.921 . . . . 0.0 111.175 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.92 121.39 18.49 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 108.761 -1.735 . . . . 0.0 108.761 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.884 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 27.0 p -63.93 123.34 18.73 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.306 -1.114 . . . . 0.0 110.897 -178.326 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.437 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 46.8 mttt -71.59 156.05 39.84 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.577 -0.702 . . . . 0.0 109.256 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 65.51 16.01 10.31 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.875 -1.141 . . . . 0.0 111.638 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.884 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 13.0 p -174.74 150.48 1.32 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.592 -1.318 . . . . 0.0 110.534 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.5 92.28 9.12 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.476 -178.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.421 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.65 -174.68 2.55 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 110.667 179.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -131.63 153.3 50.08 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.105 -0.997 . . . . 0.0 109.228 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.8 mt -107.91 139.28 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.195 -0.94 . . . . 0.0 110.592 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.1 t -137.58 161.46 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.435 -0.791 . . . . 0.0 109.477 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -47.35 130.06 13.17 Favored 'General case' 0 N--CA 1.517 2.899 0 O-C-N 121.318 -0.864 . . . . 0.0 111.187 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 106.37 8.47 33.12 Favored Glycine 0 N--CA 1.496 2.667 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.992 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.8 p -124.38 136.09 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 CA-C-N 119.909 1.855 . . . . 0.0 110.441 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.429 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.7 t -83.67 141.84 31.2 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.187 -0.946 . . . . 0.0 109.959 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.7 mtm180 -119.47 146.6 45.27 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.148 -0.97 . . . . 0.0 110.743 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.417 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 5.4 mt -121.22 111.26 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.74 137.94 13.66 Favored Glycine 0 N--CA 1.494 2.54 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.116 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HB2' ' CZ ' ' A' ' 6' ' ' PHE . 74.2 tttt -108.0 125.32 51.39 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.333 -1.098 . . . . 0.0 109.174 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.9 t -101.15 115.15 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.129 -0.982 . . . . 0.0 110.193 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.6 t -117.22 113.55 39.1 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.245 -0.909 . . . . 0.0 109.812 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.6 148.66 53.88 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 123.201 1.106 . . . . 0.0 110.481 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 N--CA 1.5 2.053 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 179.822 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.519 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.17 127.2 55.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.213 -1.169 . . . . 0.0 110.033 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 54.8 ttp -117.42 147.58 42.56 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.147 -0.971 . . . . 0.0 110.545 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 pttm -131.3 143.77 50.78 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 109.857 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -120.43 136.23 54.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.155 -0.966 . . . . 0.0 110.026 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -91.89 112.95 25.08 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.052 -1.03 . . . . 0.0 110.362 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.529 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -125.91 172.05 10.22 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.889 177.494 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.463 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 66.4 m80 -89.63 172.61 8.83 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 119.792 -0.763 . . . . 0.0 110.681 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.42 HG22 ' CE2' ' A' ' 57' ' ' PHE . 37.4 mt -72.83 -53.51 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.65 -39.35 80.33 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.011 -1.056 . . . . 0.0 109.838 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.8 m -62.73 -46.65 87.09 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.116 -0.99 . . . . 0.0 109.486 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.4 tpt -74.25 -42.75 59.15 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.285 -0.885 . . . . 0.0 109.933 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.43 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 20.6 m-85 -70.16 -25.9 63.67 Favored 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 119.214 -0.994 . . . . 0.0 110.044 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -73.74 -38.73 64.65 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.741 -1.224 . . . . 0.0 109.358 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -63.73 -41.82 97.99 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.123 -0.986 . . . . 0.0 109.411 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -59.97 -41.09 91.23 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.357 -0.84 . . . . 0.0 109.826 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -66.32 -35.19 79.75 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.25 -0.906 . . . . 0.0 110.496 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -79.78 -36.77 36.64 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.089 -1.007 . . . . 0.0 110.237 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.822 0 O-C-N 121.09 -1.006 . . . . 0.0 110.117 179.809 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.9 mttt . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.3 mt 53.17 92.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.036 -1.04 . . . . 0.0 110.319 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -110.57 136.74 49.23 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.194 -0.941 . . . . 0.0 110.022 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.33 -167.09 0.07 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.03 -1.044 . . . . 0.0 110.464 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.9 tp -117.02 38.56 3.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.194 -0.941 . . . . 0.0 110.791 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.23 37.11 0.84 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.164 -0.96 . . . . 0.0 110.535 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -131.64 37.32 3.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.206 -0.934 . . . . 0.0 109.894 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.404 ' O ' ' CD1' ' A' ' 79' ' ' TRP . 92.0 mt -140.43 152.95 46.1 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.186 -0.947 . . . . 0.0 109.79 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -84.69 98.85 10.45 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.159 -0.963 . . . . 0.0 110.186 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 153.45 -36.19 0.75 Allowed Glycine 0 N--CA 1.495 2.615 0 C-N-CA 119.65 -1.262 . . . . 0.0 110.99 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.404 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 27.4 p-90 -57.94 -29.79 65.44 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 120.928 -1.336 . . . . 0.0 111.029 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -52.41 -36.72 54.9 Favored 'General case' 0 N--CA 1.515 2.794 0 O-C-N 120.861 -1.15 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.59 -33.06 41.96 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.161 -0.962 . . . . 0.0 110.243 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.06 170.3 0.02 OUTLIER 'General case' 0 N--CA 1.518 2.94 0 O-C-N 121.024 -1.048 . . . . 0.0 110.934 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -107.56 161.13 15.12 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.177 -0.952 . . . . 0.0 110.515 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.92 -42.72 90.34 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.214 -0.929 . . . . 0.0 110.258 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -61.79 -51.94 66.24 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.264 -0.898 . . . . 0.0 109.483 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.402 ' OE2' ' CZ ' ' A' ' 10' ' ' TYR . 40.8 mt-10 -63.72 -40.0 95.67 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.006 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.3 ttpt -59.43 -38.35 80.46 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.351 -0.843 . . . . 0.0 109.845 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.413 ' O ' ' OG1' ' A' ' 91' ' ' THR . 7.4 mt-10 -63.21 -36.61 84.2 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.185 -0.947 . . . . 0.0 110.151 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -68.93 -38.29 79.4 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.07 -1.019 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.3 mt -68.74 -38.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.409 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.413 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 1.8 p -59.01 -37.71 77.55 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.946 -1.096 . . . . 0.0 109.521 178.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -56.4 -37.8 70.64 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.22 -0.925 . . . . 0.0 109.814 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.402 ' ND1' HG21 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.61 -54.35 48.09 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.125 -0.984 . . . . 0.0 109.711 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.43 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 9.4 mt -64.79 -39.34 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 C-N-CA 119.399 -0.92 . . . . 0.0 108.984 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.64 87.14 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.409 -0.916 . . . . 0.0 109.504 178.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.6 -49.23 77.42 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.075 -1.016 . . . . 0.0 109.341 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.65 -36.46 78.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.265 -0.897 . . . . 0.0 109.971 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.7 t -103.46 69.54 1.0 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.142 -0.973 . . . . 0.0 110.086 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.6 p . . . . . 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.0 110.162 179.941 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 . . . . . 0 N--CA 1.494 1.746 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.8 ttt85 -142.24 144.88 33.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.122 -0.986 . . . . 0.0 110.349 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.519 ' CE2' ' OH ' ' A' ' 51' ' ' TYR . 2.1 m-85 -117.71 140.58 49.48 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.206 -0.934 . . . . 0.0 110.203 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.3 t -130.97 125.51 33.57 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.172 -0.955 . . . . 0.0 109.372 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.1 m -103.66 134.23 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.135 -0.978 . . . . 0.0 110.352 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.32 108.11 5.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.195 -0.94 . . . . 0.0 110.318 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.436 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.4 OUTLIER -51.02 157.47 0.84 Allowed 'General case' 0 N--CA 1.514 2.752 0 O-C-N 121.135 -0.978 . . . . 0.0 110.528 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.44 139.99 32.63 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.306 -0.872 . . . . 0.0 110.002 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -127.46 -58.47 1.26 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.222 -0.924 . . . . 0.0 110.501 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.22 140.53 26.64 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.17 -0.956 . . . . 0.0 110.328 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.31 149.14 16.73 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -116.07 128.52 55.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.19 -1.183 . . . . 0.0 109.938 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.43 131.38 29.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.125 -0.985 . . . . 0.0 110.948 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.6 124.02 35.07 Favored Glycine 0 N--CA 1.493 2.495 0 N-CA-C 108.284 -1.927 . . . . 0.0 108.284 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.883 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 22.3 p -64.93 125.78 25.93 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.181 -1.188 . . . . 0.0 111.005 -178.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 157.38 37.26 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.667 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 16.8 10.71 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.878 -1.139 . . . . 0.0 111.395 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.883 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.6 p -177.75 152.42 0.78 Allowed 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.564 -1.335 . . . . 0.0 110.548 178.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -89.57 92.12 8.96 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.992 -1.067 . . . . 0.0 111.541 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.93 -173.61 2.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.401 -0.812 . . . . 0.0 110.325 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -139.19 148.99 43.89 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.014 -1.054 . . . . 0.0 109.911 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 6.9 mt -112.25 131.0 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.174 -0.954 . . . . 0.0 109.7 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.6 p -155.68 84.25 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.138 -0.976 . . . . 0.0 111.28 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 48.7 101.91 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.367 -0.833 . . . . 0.0 112.406 178.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 138.0 -22.03 3.13 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 119.392 -1.385 . . . . 0.0 112.219 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p -125.62 139.41 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 CA-C-N 119.737 1.769 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.436 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -80.18 141.6 35.51 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.202 -0.936 . . . . 0.0 109.81 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ptt85 -129.5 143.74 50.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.225 -0.922 . . . . 0.0 110.276 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.437 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 12.3 mt -111.11 126.48 68.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.186 -0.946 . . . . 0.0 109.181 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.9 154.15 16.72 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 11.3 pttp -127.8 143.43 51.13 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.129 -1.218 . . . . 0.0 109.589 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.3 t -108.53 109.66 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.012 -1.055 . . . . 0.0 109.949 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.9 t -115.39 113.22 43.29 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.186 -0.947 . . . . 0.0 109.829 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.17 150.09 53.01 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 O-C-N 123.196 1.103 . . . . 0.0 110.427 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 . . . . . 0 N--CA 1.499 2.024 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 179.845 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.447 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -146.25 130.06 17.15 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.191 -1.182 . . . . 0.0 110.173 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.6 mtt -117.96 128.22 54.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.133 -0.979 . . . . 0.0 110.588 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -126.83 123.08 36.52 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.171 -0.956 . . . . 0.0 109.792 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -118.27 142.6 47.32 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.134 -0.978 . . . . 0.0 110.411 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -99.25 114.1 26.74 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.173 -0.954 . . . . 0.0 110.611 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.519 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.3 OUTLIER -124.79 174.15 8.11 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.018 -1.051 . . . . 0.0 109.811 177.495 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.477 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 64.4 m80 -92.92 -173.7 3.37 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.454 -0.779 . . . . 0.0 110.664 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.478 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 37.9 mm -82.93 -56.63 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -58.56 -38.74 78.49 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.18 -0.95 . . . . 0.0 109.49 178.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.9 m -60.33 -51.31 70.07 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.272 -0.893 . . . . 0.0 109.104 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.5 tpt -68.8 -45.42 71.31 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.446 -0.784 . . . . 0.0 109.374 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 93' ' ' HIS . 9.5 m-85 -63.07 -30.24 71.44 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.244 -0.983 . . . . 0.0 109.949 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -65.7 -42.13 91.53 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.847 -1.158 . . . . 0.0 109.034 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -65.58 -41.04 93.33 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.277 -0.889 . . . . 0.0 108.979 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.5 mp -55.34 -41.02 71.94 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.139 -0.976 . . . . 0.0 109.152 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.11 -33.91 65.55 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.287 -0.883 . . . . 0.0 109.562 178.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -104.57 30.82 5.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.147 -0.97 . . . . 0.0 110.396 179.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.885 0 O-C-N 120.969 -1.082 . . . . 0.0 110.109 179.963 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 120.681 0.276 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.417 HG22 HD11 ' A' ' 70' ' ' ILE . 80.0 mt 54.14 99.11 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.178 -0.951 . . . . 0.0 110.797 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.9 132.35 54.28 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.0 109.729 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.94 -164.17 0.07 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.023 -1.048 . . . . 0.0 110.777 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 46.0 tp -114.02 -55.42 2.5 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.97 -36.99 60.82 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.014 -1.054 . . . . 0.0 110.724 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -50.62 -31.07 14.99 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.057 -1.027 . . . . 0.0 111.302 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.0 mt -87.35 152.19 22.48 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.889 -1.132 . . . . 0.0 110.305 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -96.31 137.13 35.84 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.243 -0.911 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.56 -49.44 0.85 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.447 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 55.6 p-90 -50.81 -32.0 18.75 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.116 -1.226 . . . . 0.0 111.151 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 3.8 tm-20 -53.52 -28.04 29.09 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.94 -1.1 . . . . 0.0 111.416 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -110.05 24.22 13.3 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.878 -1.139 . . . . 0.0 112.244 -179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.424 HD11 ' CD2' ' A' ' 10' ' ' TYR . 21.6 mt -111.1 -164.8 0.94 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.723 -1.235 . . . . 0.0 109.678 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -88.02 161.85 17.14 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.926 -1.109 . . . . 0.0 110.312 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.13 -49.26 17.81 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.923 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -61.92 -42.7 99.39 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.305 -0.872 . . . . 0.0 109.366 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.426 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 21.3 mt-10 -62.58 -40.62 97.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.3 -39.81 84.19 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.208 -0.932 . . . . 0.0 109.932 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -58.36 -39.69 80.23 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.247 -0.908 . . . . 0.0 110.062 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -59.47 -35.82 74.82 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.444 HG22 HD11 ' A' ' 90' ' ' ILE . 47.9 mm -70.46 -38.39 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.1 -1.0 . . . . 0.0 109.434 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -38.86 92.82 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.031 -1.043 . . . . 0.0 109.391 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -57.23 -35.8 70.13 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.163 -0.961 . . . . 0.0 110.016 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.478 ' CE1' ' CG2' ' A' ' 53' ' ' ILE . 1.7 m-70 -55.57 -50.01 71.21 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.05 -1.031 . . . . 0.0 109.941 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.74 -38.24 81.81 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.314 -0.954 . . . . 0.0 109.15 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.8 -39.63 83.97 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.575 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.43 -39.92 94.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.19 -0.944 . . . . 0.0 109.414 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -82.52 -34.77 27.79 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.9 m -103.69 60.56 0.75 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.133 -0.979 . . . . 0.0 109.983 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.496 1.866 0 O-C-N 121.053 -1.03 . . . . 0.0 110.25 179.906 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 120.586 0.232 . . . . 0.0 110.456 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 -133.69 138.73 46.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.141 -0.974 . . . . 0.0 110.344 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.421 ' CZ ' ' HD2' ' A' ' 34' ' ' LYS . 0.9 OUTLIER -131.55 141.04 49.61 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.291 -0.881 . . . . 0.0 109.675 179.986 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -152.69 166.72 31.26 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.33 -0.856 . . . . 0.0 109.956 179.199 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.442 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 6.1 m -104.64 141.4 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 120.864 -1.148 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.436 ' CB ' ' CZ3' ' A' ' 50' ' ' TRP . 10.1 t0 -136.91 147.92 46.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.298 -0.877 . . . . 0.0 109.261 179.224 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.425 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 59.9 m-85 -102.48 154.29 19.23 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.22 -0.925 . . . . 0.0 110.311 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.08 133.9 34.21 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.26 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -134.15 106.06 6.98 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 52.97 95.07 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.041 -1.037 . . . . 0.0 110.806 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.6 144.38 4.81 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.709 -1.356 . . . . 0.0 109.709 179.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 p -117.77 134.49 54.86 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.219 -1.165 . . . . 0.0 110.125 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.83 134.35 49.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.189 -0.944 . . . . 0.0 110.721 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.82 124.62 31.18 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . 22.4 t -62.41 128.53 36.47 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.355 -1.086 . . . . 0.0 109.337 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 145.94 47.97 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.5 mttt 52.58 48.74 21.89 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.901 -1.124 . . . . 0.0 109.732 -179.231 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.69 151.42 9.2 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.351 -0.843 . . . . 0.0 110.656 -178.328 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -101.93 49.76 0.85 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.138 -0.976 . . . . 0.0 108.57 178.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.6 -174.1 4.23 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.474 -0.766 . . . . 0.0 110.18 -178.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -133.31 159.66 39.61 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.118 -0.989 . . . . 0.0 109.914 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 62.9 mt -104.51 105.02 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.409 -0.807 . . . . 0.0 109.526 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 12.8 p -104.65 161.66 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.188 -0.945 . . . . 0.0 110.583 -179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -46.13 138.57 5.17 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.466 -0.771 . . . . 0.0 111.195 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.02 0.77 51.64 Favored Glycine 0 N--CA 1.493 2.466 0 C-N-CA 120.163 -1.018 . . . . 0.0 111.036 -179.202 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.4 p -125.62 135.58 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-N 119.549 1.674 . . . . 0.0 109.86 179.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.0 t -89.44 138.84 31.09 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 -179.609 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.45 154.1 45.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.334 -0.854 . . . . 0.0 110.138 179.83 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.8 mt -102.07 136.53 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.18 -0.95 . . . . 0.0 110.185 -179.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.421 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.1 126.0 8.51 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.574 -1.81 . . . . 0.0 108.574 179.183 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HD2' ' CZ ' ' A' ' 6' ' ' PHE . 74.8 tttt -105.13 114.62 28.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.177 -1.19 . . . . 0.0 109.742 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -96.04 121.2 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.212 -0.93 . . . . 0.0 110.429 -179.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.7 t -119.86 110.75 36.39 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.215 -0.928 . . . . 0.0 109.417 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.03 147.61 43.49 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.24 1.126 . . . . 0.0 110.638 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.8 m120 . . . . . 0 N--CA 1.499 2.014 0 O-C-N 121.268 -0.895 . . . . 0.0 110.006 179.705 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.586 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -143.56 142.47 31.11 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.175 -1.191 . . . . 0.0 110.299 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.6 mtt -116.39 140.59 49.18 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.21 -0.931 . . . . 0.0 110.148 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -129.75 122.64 29.27 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.133 -0.979 . . . . 0.0 110.54 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -116.65 145.45 43.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.142 -0.974 . . . . 0.0 109.694 179.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.436 ' CZ3' ' CB ' ' A' ' 9' ' ' ASP . 16.6 m95 -97.37 139.82 32.75 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.108 -0.995 . . . . 0.0 110.084 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -125.43 173.19 9.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 110.064 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.4 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 1.7 m80 -90.91 -172.67 3.43 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.526 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.455 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 44.5 mm -84.79 -40.29 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 120.962 -1.086 . . . . 0.0 109.161 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -86.45 -31.11 21.55 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.997 -1.064 . . . . 0.0 110.634 178.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 78.9 m -66.56 -51.01 61.17 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.951 -1.093 . . . . 0.0 109.923 179.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.22 -40.21 90.14 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.007 -179.716 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.488 ' CD2' ' CD2' ' A' ' 93' ' ' HIS . 5.8 m-85 -70.44 -32.62 70.28 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 118.938 -1.105 . . . . 0.0 109.553 178.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.96 -36.97 78.25 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.97 -1.081 . . . . 0.0 109.592 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -59.29 -40.18 85.33 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.122 -0.986 . . . . 0.0 109.787 179.469 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -57.72 -42.66 84.28 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.194 -0.942 . . . . 0.0 109.327 179.286 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.95 -34.04 71.31 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.625 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -107.55 31.01 5.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.19 -0.944 . . . . 0.0 110.639 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.891 0 O-C-N 120.995 -1.066 . . . . 0.0 110.136 179.854 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.8 mttt . . . . . 0 N--CA 1.494 1.761 0 CA-C-O 120.708 0.29 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.437 HG23 HD11 ' A' ' 70' ' ' ILE . 74.5 mt 54.36 98.74 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.14 -0.975 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -112.82 137.55 50.99 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.086 -1.009 . . . . 0.0 109.996 179.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.42 -164.04 0.09 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.998 -1.063 . . . . 0.0 110.704 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.429 HD21 ' OG1' ' A' ' 91' ' ' THR . 56.6 tp -112.87 160.32 18.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.104 -0.997 . . . . 0.0 110.137 -179.778 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.422 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER 60.36 46.24 10.23 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.037 -1.039 . . . . 0.0 110.178 -179.829 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -112.91 -62.27 1.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.142 -0.974 . . . . 0.0 109.537 179.348 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.408 ' O ' ' O ' ' A' ' 6' ' ' PHE . 0.9 OUTLIER -138.3 65.62 1.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.266 -0.896 . . . . 0.0 109.491 178.732 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.442 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 10.2 pt-20 -143.01 141.87 31.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.858 -1.151 . . . . 0.0 110.956 179.492 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.76 68.54 1.89 Allowed Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.186 -1.566 . . . . 0.0 109.186 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.422 ' CE2' HG22 ' A' ' 74' ' ' THR . 58.6 p-90 -91.81 -32.87 15.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.147 -1.208 . . . . 0.0 111.207 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -52.54 -29.42 25.34 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.838 -1.164 . . . . 0.0 111.17 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -94.86 -38.73 10.6 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.852 -1.155 . . . . 0.0 110.618 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.425 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 92.5 mt -70.67 -175.69 1.13 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.949 -1.095 . . . . 0.0 110.015 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -63.91 150.13 45.67 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.225 -0.922 . . . . 0.0 110.16 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -88.45 -39.95 13.85 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.246 -0.909 . . . . 0.0 110.32 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -58.03 -40.82 81.83 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 121.245 -0.909 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.404 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.4 mt-10 -59.78 -39.56 85.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.285 -0.884 . . . . 0.0 109.764 179.624 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -58.69 -38.52 78.41 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.185 -0.947 . . . . 0.0 110.09 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -59.06 -45.69 90.15 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.733 179.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -59.17 -34.24 71.87 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.224 -0.922 . . . . 0.0 110.164 179.299 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.5 mm -58.9 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.056 -1.028 . . . . 0.0 109.439 179.419 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.429 ' OG1' HD21 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -57.69 -41.38 81.53 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.095 -1.003 . . . . 0.0 109.649 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -62.56 -41.55 98.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.214 179.207 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.488 ' CD2' ' CD2' ' A' ' 57' ' ' PHE . 72.9 t60 -60.65 -46.47 90.18 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.266 -0.896 . . . . 0.0 109.567 179.541 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.429 HG12 ' CE1' ' A' ' 57' ' ' PHE . 25.7 mt -62.41 -39.5 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.181 -0.95 . . . . 0.0 109.396 179.422 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.403 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -60.47 -39.97 89.57 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.202 -0.936 . . . . 0.0 109.717 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -61.44 -44.22 97.5 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.261 -0.9 . . . . 0.0 109.345 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.0 tp -60.23 -35.1 74.68 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.353 -0.842 . . . . 0.0 110.035 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.0 t -100.59 67.29 1.28 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.053 -1.029 . . . . 0.0 110.077 179.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 8.4 m . . . . . 0 N--CA 1.493 1.705 0 O-C-N 121.115 -0.991 . . . . 0.0 110.184 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 . . . . . 0 N--CA 1.495 1.793 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.24 153.79 42.63 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.222 -0.924 . . . . 0.0 110.393 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.525 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.6 OUTLIER -146.13 134.85 22.28 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.344 -0.848 . . . . 0.0 109.866 -179.943 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 p -152.73 165.49 35.13 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.052 -1.03 . . . . 0.0 109.871 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.418 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 11.1 m -101.81 116.23 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 120.91 -1.119 . . . . 0.0 110.606 179.618 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -105.0 141.78 35.97 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.019 -1.051 . . . . 0.0 109.239 179.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 83' ' ' GLU . 73.2 m-85 -100.35 152.14 20.67 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.156 -0.965 . . . . 0.0 110.192 -179.793 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -100.68 135.54 41.96 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.363 -0.836 . . . . 0.0 110.025 179.664 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 mtpt -114.18 -55.1 2.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.146 -0.971 . . . . 0.0 110.348 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -133.8 156.13 48.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.185 -0.947 . . . . 0.0 110.256 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 162.61 24.13 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.4 m -138.31 145.42 41.2 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.226 -1.161 . . . . 0.0 110.192 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -140.92 141.85 34.49 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.218 -0.926 . . . . 0.0 110.736 -179.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.41 127.58 44.14 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.33 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.907 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 31.3 p -65.74 121.65 15.48 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.148 -1.207 . . . . 0.0 110.931 -178.425 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 29.7 mmtt -66.89 156.32 36.08 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.335 -0.853 . . . . 0.0 108.972 179.717 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.84 16.35 10.41 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.84 -1.163 . . . . 0.0 111.92 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.907 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.4 p -175.24 149.33 1.05 Allowed 'General case' 0 N--CA 1.504 2.256 0 O-C-N 120.571 -1.33 . . . . 0.0 110.726 178.095 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -86.64 88.36 7.65 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.021 -1.049 . . . . 0.0 111.678 -178.021 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -165.27 -173.73 2.96 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 179.01 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -130.81 153.8 48.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.019 -1.051 . . . . 0.0 109.833 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.4 mt -107.73 122.5 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.277 -0.889 . . . . 0.0 109.969 -179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 12.2 p -120.09 160.3 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.243 -0.911 . . . . 0.0 110.323 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.7 pttt -47.83 132.04 14.84 Favored 'General case' 0 N--CA 1.515 2.821 0 O-C-N 121.386 -0.821 . . . . 0.0 111.28 -179.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.4 8.59 40.53 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.117 -1.039 . . . . 0.0 111.727 -179.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.7 p -124.97 137.01 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-N 119.723 1.762 . . . . 0.0 110.612 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.1 t -94.43 133.46 38.01 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.161 -0.962 . . . . 0.0 109.942 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.24 148.61 50.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.266 -0.896 . . . . 0.0 110.151 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.42 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 10.1 mt -104.36 123.89 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.083 -1.01 . . . . 0.0 109.425 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.436 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -106.02 143.93 15.77 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 179.569 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 27.4 tttt -108.37 117.17 33.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -1.136 . . . . 0.0 108.774 179.679 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -96.4 108.7 21.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.01 -1.056 . . . . 0.0 110.467 -179.421 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.62 143.43 41.7 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.301 -0.874 . . . . 0.0 110.041 179.354 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -76.22 143.77 25.69 Favored 'Trans proline' 0 C--N 1.317 -1.084 0 O-C-N 123.101 1.053 . . . . 0.0 110.342 -179.884 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.9 m120 . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.189 -0.944 . . . . 0.0 110.088 179.783 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.497 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -132.77 151.42 52.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.205 -1.173 . . . . 0.0 110.038 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.6 ttp -113.6 130.99 56.28 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.226 -0.921 . . . . 0.0 110.53 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -139.15 136.77 35.46 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.948 . . . . 0.0 110.084 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -122.1 153.48 38.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.174 -0.954 . . . . 0.0 109.399 179.856 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.436 ' CZ3' ' HA2' ' A' ' 33' ' ' GLY . 16.1 m95 -107.5 114.1 27.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.109 -0.994 . . . . 0.0 111.033 -179.872 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -123.35 171.32 9.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.193 -0.942 . . . . 0.0 109.224 177.412 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.451 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 58.9 m80 -86.72 -175.19 5.32 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.269 -179.78 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.447 HG23 ' CG ' ' A' ' 93' ' ' HIS . 31.9 mm -85.33 -47.06 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 178.211 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -64.85 -40.01 94.46 Favored 'General case' 0 N--CA 1.504 2.234 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.056 178.126 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 51.1 m -62.09 -45.99 91.04 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.084 179.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -70.19 -46.65 64.15 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.414 -0.804 . . . . 0.0 109.661 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -67.13 -28.96 68.58 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.975 179.368 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -76.83 -42.74 39.15 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.777 -1.202 . . . . 0.0 108.899 178.545 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.2 tptp -66.77 -39.76 87.98 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.42 -0.912 . . . . 0.0 108.796 178.415 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.0 tp -55.74 -41.22 73.61 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.256 -0.902 . . . . 0.0 109.21 178.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -59.75 -34.86 73.5 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.288 -0.883 . . . . 0.0 109.555 178.542 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 -108.77 32.65 4.72 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.145 -0.972 . . . . 0.0 110.538 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.213 0 O-C-N 120.954 -1.092 . . . . 0.0 110.305 179.946 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.1 mtmt . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 120.799 0.333 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.2 mt -111.37 120.2 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -114.05 152.78 30.5 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.273 -0.892 . . . . 0.0 109.724 179.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 52.86 -165.23 0.07 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.027 -1.046 . . . . 0.0 110.487 -179.753 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.421 ' O ' ' OG1' ' A' ' 74' ' ' THR . 1.6 tp -138.02 -164.78 1.68 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.147 -0.971 . . . . 0.0 110.162 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 73' ' ' LEU . 4.5 p 46.84 43.3 13.13 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.169 -0.957 . . . . 0.0 111.204 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -113.43 -55.84 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.251 -0.905 . . . . 0.0 110.055 179.833 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.412 ' N ' ' CD2' ' A' ' 76' ' ' LEU . 1.3 pt? -146.59 63.42 1.2 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.082 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 5.2 pt-20 -144.46 141.28 29.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.063 -1.023 . . . . 0.0 110.699 178.888 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.08 66.2 3.46 Favored Glycine 0 N--CA 1.496 2.672 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.439 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.422 ' CZ3' ' HD3' ' A' ' 87' ' ' LYS . 51.1 p-90 -90.91 -39.22 12.41 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.073 -1.251 . . . . 0.0 110.512 179.865 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.86 -24.13 67.44 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.227 -0.921 . . . . 0.0 111.072 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -95.96 -29.63 14.06 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.714 -1.241 . . . . 0.0 111.497 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.1 mt -94.77 -79.79 0.42 Allowed 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.8 -1.187 . . . . 0.0 110.773 -179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 5.8 mt-10 -125.39 132.62 52.74 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.7 -1.25 . . . . 0.0 110.829 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -89.07 -43.94 10.72 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.13 -0.981 . . . . 0.0 109.554 178.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -62.02 -40.99 97.56 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.365 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -56.08 -38.99 71.43 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.219 -0.925 . . . . 0.0 109.683 179.058 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.422 ' HD3' ' CZ3' ' A' ' 79' ' ' TRP . 1.3 ttpt -55.53 -38.17 68.9 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.08 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.4 -44.17 97.61 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 109.607 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -64.11 -39.07 93.25 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.261 -0.899 . . . . 0.0 109.883 179.633 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.6 mt -61.41 -35.1 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.219 -0.925 . . . . 0.0 109.546 179.367 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 3.7 m -60.77 -38.95 86.99 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.812 -1.18 . . . . 0.0 109.576 179.134 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -57.13 -38.53 73.6 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.266 -0.896 . . . . 0.0 109.901 179.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.447 ' CG ' HG23 ' A' ' 53' ' ' ILE . 1.9 m-70 -53.05 -43.47 66.68 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.06 -1.025 . . . . 0.0 110.178 179.753 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 1.5 mp -65.97 -40.55 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.323 -0.951 . . . . 0.0 108.873 179.506 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.49 -36.95 81.93 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.969 179.312 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -70.63 -37.75 73.83 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.2 tp -79.73 -31.94 41.12 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.046 -1.034 . . . . 0.0 110.736 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.3 m -92.04 -39.48 11.62 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.192 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 N--CA 1.494 1.748 0 O-C-N 121.081 -1.012 . . . . 0.0 110.1 179.885 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -141.97 135.18 29.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.178 -0.951 . . . . 0.0 110.228 -179.913 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.432 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.1 m-85 -118.37 137.55 53.04 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.212 -0.93 . . . . 0.0 110.127 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.7 m -122.78 159.47 27.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.186 -0.946 . . . . 0.0 109.295 179.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 25.8 m -130.08 116.17 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.038 -1.038 . . . . 0.0 110.311 179.577 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.16 151.82 37.66 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.999 -1.063 . . . . 0.0 110.298 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.452 ' OH ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -104.97 144.77 31.35 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.309 -0.87 . . . . 0.0 109.602 179.739 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.03 113.35 25.02 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.168 -0.957 . . . . 0.0 110.386 -179.762 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -113.48 -56.06 2.45 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.236 -0.915 . . . . 0.0 109.886 179.733 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.2 ttm-85 -125.52 39.02 4.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.178 -0.951 . . . . 0.0 110.133 179.768 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.12 155.06 25.94 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 t -146.59 146.03 30.3 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.286 -1.126 . . . . 0.0 110.279 179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -156.08 149.01 24.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.193 -0.942 . . . . 0.0 111.589 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.96 125.88 41.02 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.09 140.9 56.57 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.309 -1.112 . . . . 0.0 110.361 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.99 153.8 20.72 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.36 33.01 22.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.84 -1.163 . . . . 0.0 109.664 -178.761 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 132.0 0.09 Allowed 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.772 -1.205 . . . . 0.0 109.372 -179.768 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.36 72.61 4.9 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.07 -1.019 . . . . 0.0 109.91 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -151.33 -175.52 5.21 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.247 -0.908 . . . . 0.0 110.318 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -133.38 156.83 46.95 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.914 -1.116 . . . . 0.0 109.756 -179.27 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.4 mt -105.03 114.95 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.344 -0.847 . . . . 0.0 109.617 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.9 t -110.61 160.93 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.21 -0.931 . . . . 0.0 110.3 -179.562 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -47.11 144.75 2.48 Favored 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.406 -0.809 . . . . 0.0 111.125 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 90.17 9.67 65.17 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.072 -1.061 . . . . 0.0 111.068 -179.35 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.5 p -125.1 133.95 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 119.485 1.642 . . . . 0.0 110.191 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 25.4 p -89.99 139.04 30.99 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.167 -0.958 . . . . 0.0 110.0 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.09 150.67 52.04 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.238 -0.913 . . . . 0.0 110.616 -179.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.407 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 20.5 mt -113.32 134.46 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.288 -0.883 . . . . 0.0 109.537 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.78 127.92 9.16 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.473 ' CB ' ' OH ' ' A' ' 51' ' ' TYR . 17.5 tttp -103.15 118.36 36.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.128 -1.219 . . . . 0.0 109.585 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.2 t -94.31 119.2 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.175 -0.953 . . . . 0.0 110.189 -179.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.0 t -116.44 111.94 41.67 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.201 -0.937 . . . . 0.0 109.698 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.04 140.96 32.15 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 O-C-N 123.123 1.065 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 . . . . . 0 N--CA 1.498 1.944 0 O-C-N 121.178 -0.951 . . . . 0.0 110.138 179.693 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.409 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -143.13 143.64 31.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.168 -1.195 . . . . 0.0 110.227 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.1 ttp -114.85 124.15 51.0 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.208 -0.932 . . . . 0.0 110.25 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.415 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.2 OUTLIER -138.08 123.09 19.06 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.198 -0.939 . . . . 0.0 110.178 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -120.63 156.41 31.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.092 -1.005 . . . . 0.0 109.818 179.517 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.415 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 64.8 m95 -100.53 118.63 37.1 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.086 -1.009 . . . . 0.0 110.562 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.473 ' OH ' ' CB ' ' A' ' 34' ' ' LYS . 0.2 OUTLIER -132.58 163.26 29.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.182 -0.949 . . . . 0.0 110.282 178.301 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -58.5 -172.29 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.421 -0.8 . . . . 0.0 109.749 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.458 HG22 HD11 ' A' ' 53' ' ' ILE . 41.3 mm -88.12 -50.8 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.097 -1.002 . . . . 0.0 109.118 179.448 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.6 tttp -56.37 -28.33 58.85 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.347 -0.846 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.9 m -65.07 -39.08 92.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 120.856 -1.152 . . . . 0.0 110.251 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.2 tpt -80.31 -40.64 26.4 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.144 -0.973 . . . . 0.0 109.195 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -70.47 -29.29 65.81 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.369 -0.933 . . . . 0.0 109.901 178.526 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -65.96 -38.1 87.71 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.918 -1.114 . . . . 0.0 109.458 179.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -58.08 -37.79 75.15 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.116 -0.99 . . . . 0.0 109.938 179.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.34 -41.56 76.47 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 109.519 179.484 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -68.29 -34.56 76.39 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.267 -0.896 . . . . 0.0 110.234 179.465 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -37.09 33.81 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.065 -1.022 . . . . 0.0 110.284 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.013 -1.054 . . . . 0.0 110.093 179.953 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.8 mtmm . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 120.786 0.327 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.416 HG22 HD11 ' A' ' 70' ' ' ILE . 79.5 mt 52.93 94.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 120.982 -1.074 . . . . 0.0 110.596 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -113.04 133.64 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.193 -0.942 . . . . 0.0 109.837 179.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t70 52.7 -163.91 0.08 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.002 -1.061 . . . . 0.0 110.466 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.426 HD21 ' OG1' ' A' ' 91' ' ' THR . 17.0 tp -110.64 -59.5 1.94 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 81.96 0.1 Allowed 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.131 -0.981 . . . . 0.0 109.343 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -166.27 -53.42 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.329 -0.857 . . . . 0.0 110.647 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.9 mt -62.38 150.94 38.28 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.262 -0.899 . . . . 0.0 109.462 179.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -78.8 118.23 20.66 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.137 -0.977 . . . . 0.0 110.516 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.65 -41.04 0.95 Allowed Glycine 0 N--CA 1.492 2.406 0 C-N-CA 119.646 -1.264 . . . . 0.0 110.942 179.313 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.426 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 30.1 p-90 -57.62 -28.78 63.98 Favored 'General case' 0 N--CA 1.512 2.669 0 CA-C-N 118.838 1.319 . . . . 0.0 111.157 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . 0.426 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.1 tp10 -53.66 -27.63 28.6 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.819 -1.176 . . . . 0.0 111.462 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -109.42 24.33 13.24 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.717 -1.239 . . . . 0.0 112.302 -179.342 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.8 mt -111.79 -163.33 0.84 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.701 -1.249 . . . . 0.0 109.5 179.283 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -99.64 162.02 13.26 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.93 -1.106 . . . . 0.0 110.47 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.11 -46.98 26.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.263 -0.898 . . . . 0.0 110.08 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -61.52 -46.16 91.14 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.24 -0.913 . . . . 0.0 109.426 179.753 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.452 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 23.1 mt-10 -62.15 -39.91 94.21 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.274 179.095 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt -56.0 -37.97 69.84 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.201 -0.937 . . . . 0.0 109.763 179.006 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.41 -38.67 74.68 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.224 -0.923 . . . . 0.0 109.879 179.299 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -59.65 -40.73 88.65 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 109.88 179.634 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.2 mt -65.61 -38.29 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 121.317 -0.864 . . . . 0.0 109.399 179.312 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.426 ' OG1' HD21 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -60.52 -38.51 84.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.989 -1.069 . . . . 0.0 109.497 179.042 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -56.82 -38.14 72.18 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.224 -0.923 . . . . 0.0 109.873 179.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.425 ' CD2' HG23 ' A' ' 53' ' ' ILE . 2.7 m-70 -56.32 -51.39 68.39 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.092 -1.005 . . . . 0.0 109.777 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -62.29 -38.77 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.256 -0.903 . . . . 0.0 109.324 179.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.58 -40.95 89.17 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.204 -0.935 . . . . 0.0 109.526 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.19 -41.83 99.25 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.059 179.177 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.3 tp -76.26 -35.03 59.14 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.338 -0.851 . . . . 0.0 109.695 178.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.4 m -106.44 66.85 0.71 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.053 -1.029 . . . . 0.0 110.041 179.626 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.091 0 O-C-N 121.06 -1.025 . . . . 0.0 110.052 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -115.97 152.47 33.42 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.195 -0.94 . . . . 0.0 110.301 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.528 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.6 OUTLIER -144.93 135.59 24.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.375 -0.828 . . . . 0.0 109.781 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -153.24 165.56 35.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.059 179.227 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.402 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 10.2 m -100.75 120.33 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.052 -1.03 . . . . 0.0 110.224 179.451 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.419 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 0.6 OUTLIER -115.15 99.29 7.32 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.102 -0.999 . . . . 0.0 110.099 179.838 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.45 ' OH ' ' CB ' ' A' ' 86' ' ' GLU . 40.3 m-85 -52.61 156.16 1.97 Allowed 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.144 -0.973 . . . . 0.0 110.427 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.26 112.66 24.65 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.39 -0.819 . . . . 0.0 110.332 -179.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -148.12 38.99 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.309 -0.87 . . . . 0.0 110.416 179.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 ttp85 -151.52 39.42 0.65 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.15 -0.969 . . . . 0.0 110.595 -179.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.84 -171.43 14.52 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 179.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 61.2 m -117.59 142.85 46.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.251 179.991 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.0 140.0 25.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.998 . . . . 0.0 110.91 -179.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.19 140.58 44.81 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 108.614 -1.795 . . . . 0.0 108.614 179.254 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 0.888 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 21.1 p -80.65 125.32 29.87 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.096 -1.238 . . . . 0.0 111.081 -178.882 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 156.99 38.0 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.839 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.54 16.15 10.37 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.813 -1.18 . . . . 0.0 111.411 -178.68 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.888 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.0 p -176.46 152.37 1.06 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.528 -1.357 . . . . 0.0 110.589 177.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 tptm -88.91 91.42 8.82 Favored 'General case' 0 N--CA 1.512 2.663 0 O-C-N 120.969 -1.082 . . . . 0.0 111.598 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.9 tt0 -168.35 -174.41 2.25 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.247 -0.908 . . . . 0.0 110.577 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.5 mttp -128.49 152.76 47.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.001 -1.062 . . . . 0.0 109.709 179.825 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 61.3 mt -107.75 98.85 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.222 -0.924 . . . . 0.0 109.959 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.1 t -105.08 160.58 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.33 -0.856 . . . . 0.0 110.006 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -48.28 134.23 14.87 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 121.442 -0.786 . . . . 0.0 111.085 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.18 6.67 44.87 Favored Glycine 0 N--CA 1.495 2.58 0 C-N-CA 120.176 -1.011 . . . . 0.0 111.496 -179.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.4 p -125.59 137.49 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-N 119.681 1.741 . . . . 0.0 110.45 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 t -92.19 136.35 33.25 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.181 -0.949 . . . . 0.0 110.074 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 ptt-85 -135.27 149.14 49.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 179.928 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.413 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 15.6 mt -110.18 126.68 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.181 -0.949 . . . . 0.0 109.784 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.41 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.75 145.16 15.89 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.677 -1.769 . . . . 0.0 108.677 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 28.2 ttpt -111.95 125.08 53.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.192 -1.181 . . . . 0.0 109.057 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.7 t -100.26 109.58 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.072 -1.018 . . . . 0.0 110.506 -179.701 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.59 134.89 24.72 Favored Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.205 -0.934 . . . . 0.0 109.818 179.637 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.24 127.78 11.54 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.107 1.056 . . . . 0.0 110.207 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.1 t30 . . . . . 0 N--CA 1.498 1.97 0 O-C-N 121.146 -0.971 . . . . 0.0 110.186 179.813 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.535 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -116.5 150.52 37.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.258 -1.143 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.3 mtt -111.99 147.39 36.04 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.234 -0.916 . . . . 0.0 110.203 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.0 ptpt -143.3 134.61 26.0 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.206 -0.934 . . . . 0.0 110.271 -179.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -112.15 159.57 18.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.754 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.419 ' CZ3' ' HB2' ' A' ' 9' ' ' ASP . 9.1 m95 -110.7 113.77 26.63 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.024 -1.047 . . . . 0.0 111.311 -179.729 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.528 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.4 OUTLIER -126.13 170.07 12.17 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.27 177.205 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.47 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 68.1 m80 -89.21 161.32 16.5 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.836 -0.746 . . . . 0.0 110.463 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.435 HG23 ' CG ' ' A' ' 93' ' ' HIS . 27.9 mt -65.53 -47.14 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.078 178.405 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.2 tttt -61.42 -40.73 95.49 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.279 -0.968 . . . . 0.0 109.214 178.609 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.3 m -63.92 -43.71 95.1 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.316 -0.865 . . . . 0.0 109.013 178.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.34 -45.58 54.28 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.431 -0.793 . . . . 0.0 109.775 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.421 ' CE2' HG22 ' A' ' 53' ' ' ILE . 10.6 m-85 -65.48 -28.81 69.47 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.618 179.033 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -64.47 -41.99 96.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.831 -1.168 . . . . 0.0 109.034 178.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.1 tptt -72.56 -41.44 65.76 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.375 -0.93 . . . . 0.0 108.702 178.399 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -39.95 94.11 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.529 -0.868 . . . . 0.0 108.857 178.62 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.05 -32.3 66.06 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.128 -0.982 . . . . 0.0 109.663 178.435 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -102.36 28.82 5.61 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.174 -0.954 . . . . 0.0 110.749 179.219 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.877 0 O-C-N 120.794 -1.191 . . . . 0.0 110.356 179.837 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mttp . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 120.804 0.335 . . . . 0.0 110.605 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.4 mt 54.35 101.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.258 -0.901 . . . . 0.0 111.093 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -112.22 146.65 37.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.319 -0.863 . . . . 0.0 109.014 178.826 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t0 53.81 -161.7 0.12 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.922 -1.111 . . . . 0.0 110.148 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.418 HD23 ' OG1' ' A' ' 91' ' ' THR . 4.8 tp -112.54 -60.0 1.93 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.952 -1.092 . . . . 0.0 110.614 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.406 HG21 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -72.72 73.36 1.08 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.162 -0.962 . . . . 0.0 109.925 -179.749 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -129.15 -58.35 1.14 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.19 -0.944 . . . . 0.0 110.309 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.414 ' N ' ' CD2' ' A' ' 76' ' ' LEU . 1.3 pt? -147.87 63.83 1.12 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.968 -1.083 . . . . 0.0 110.796 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 8.7 pt-20 -144.42 140.2 28.85 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.01 -1.056 . . . . 0.0 110.266 178.299 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.59 69.01 1.2 Allowed Glycine 0 N--CA 1.498 2.814 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.436 ' CE3' ' CE ' ' A' ' 87' ' ' LYS . 59.5 p-90 -92.49 -36.25 13.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.118 -1.224 . . . . 0.0 110.805 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -53.17 -28.92 28.86 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.057 -1.027 . . . . 0.0 111.363 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -96.38 -34.88 11.38 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.889 -1.132 . . . . 0.0 111.18 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.426 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 61.3 mt -74.7 -173.8 1.94 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.956 -1.09 . . . . 0.0 110.256 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.3 152.67 33.06 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.193 -0.942 . . . . 0.0 110.71 -179.399 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -89.78 -39.2 13.27 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.237 -0.914 . . . . 0.0 110.437 179.661 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.89 -44.25 86.59 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.046 -1.033 . . . . 0.0 109.971 -179.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.45 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 9.3 mt-10 -60.52 -39.81 89.17 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.444 179.175 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.436 ' CE ' ' CE3' ' A' ' 79' ' ' TRP . 0.3 OUTLIER -55.78 -38.19 69.57 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.904 179.182 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -41.66 90.15 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.865 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.45 -32.7 72.69 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.267 -0.896 . . . . 0.0 110.656 179.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.12 -39.0 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 120.979 -1.076 . . . . 0.0 109.675 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.418 ' OG1' HD23 ' A' ' 73' ' ' LEU . 41.6 m -59.01 -39.09 80.82 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.964 -1.085 . . . . 0.0 109.892 179.649 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -56.32 -37.28 69.72 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.203 -0.936 . . . . 0.0 109.975 179.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.435 ' CG ' HG23 ' A' ' 53' ' ' ILE . 2.5 m-70 -57.46 -51.96 67.32 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.01 . . . . 0.0 110.008 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.3 mp -64.24 -38.62 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.31 179.642 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.66 81.43 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.203 -0.935 . . . . 0.0 109.741 179.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -66.57 -39.55 88.52 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.179 -0.951 . . . . 0.0 109.873 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -74.31 -34.73 63.57 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.281 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 74.8 m -96.53 58.09 1.69 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.027 -1.045 . . . . 0.0 110.094 179.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 90.9 p . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.131 -0.981 . . . . 0.0 110.253 179.934 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 . . . . . 0 N--CA 1.493 1.712 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.99 151.51 36.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.25 -0.906 . . . . 0.0 110.215 -179.943 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.434 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.1 m-85 -149.27 136.45 19.93 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.304 -0.873 . . . . 0.0 110.205 -179.65 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 76' ' ' LEU . 26.2 p -151.93 157.66 42.1 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.227 -0.921 . . . . 0.0 109.807 178.735 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -102.3 141.44 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.834 -1.166 . . . . 0.0 110.798 179.869 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -141.97 148.24 38.27 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.269 -0.894 . . . . 0.0 109.607 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.422 ' CD2' HD12 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -96.02 151.61 19.29 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.085 -1.01 . . . . 0.0 109.873 179.917 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -92.95 147.14 23.09 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.289 -0.882 . . . . 0.0 110.546 -179.578 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -120.1 -57.83 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.29 -0.881 . . . . 0.0 110.056 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -139.29 132.54 29.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.184 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.15 164.67 14.49 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 179.898 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.9 m -135.0 143.71 46.97 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -1.159 . . . . 0.0 110.258 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.32 143.82 34.26 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.222 -0.924 . . . . 0.0 110.884 -179.85 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.05 127.87 13.46 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.09 130.39 44.45 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.358 -1.084 . . . . 0.0 109.381 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HB3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -61.92 147.86 45.45 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 109.212 179.793 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 mttt 52.6 45.41 28.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.905 -1.122 . . . . 0.0 109.591 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 31.6 t -164.89 144.72 7.14 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.386 -0.821 . . . . 0.0 110.769 -178.156 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.75 56.71 1.29 Allowed 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -145.63 -172.05 3.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.374 -0.829 . . . . 0.0 110.238 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -135.31 159.29 42.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.193 -0.942 . . . . 0.0 109.629 -179.6 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 74.3 mt -107.92 119.36 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.41 -0.806 . . . . 0.0 110.057 -179.781 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 32.4 m -118.7 166.2 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.202 -0.936 . . . . 0.0 110.584 -179.845 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -48.13 143.28 4.57 Favored 'General case' 0 N--CA 1.515 2.784 0 O-C-N 121.512 -0.742 . . . . 0.0 111.023 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 96.3 5.83 59.07 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.15 -1.024 . . . . 0.0 111.239 -179.362 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -126.89 133.63 68.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 119.545 1.673 . . . . 0.0 109.977 179.796 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.2 t -81.13 139.31 35.69 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.052 -1.03 . . . . 0.0 109.341 179.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.8 mtp180 -124.21 142.9 50.85 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.176 -0.952 . . . . 0.0 110.697 -178.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.9 mt -96.74 129.01 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.105 -0.997 . . . . 0.0 109.375 178.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.9 122.72 7.7 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 58.4 tttt -106.25 122.07 45.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.217 -1.166 . . . . 0.0 109.703 -179.79 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -101.0 115.54 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.996 . . . . 0.0 110.361 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.2 t -120.73 111.67 34.33 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.214 -0.929 . . . . 0.0 109.762 179.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.08 131.01 14.91 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.131 1.069 . . . . 0.0 110.431 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.231 -0.918 . . . . 0.0 110.035 179.734 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.419 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -133.47 151.17 51.75 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.216 -1.167 . . . . 0.0 110.466 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttt -110.91 142.8 42.49 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.337 -0.852 . . . . 0.0 110.019 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.412 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -119.6 124.84 47.34 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.166 -0.959 . . . . 0.0 110.328 -179.769 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -112.15 146.88 37.26 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.142 -0.974 . . . . 0.0 109.627 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.412 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 18.0 m95 -98.88 128.17 44.99 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.181 -0.95 . . . . 0.0 110.281 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.423 ' CE2' ' HB3' ' A' ' 19' ' ' LYS . 86.9 m-85 -111.56 172.8 6.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -90.25 -173.09 3.7 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.534 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.507 HG23 ' NE2' ' A' ' 93' ' ' HIS . 40.5 mm -87.28 -38.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.005 -1.06 . . . . 0.0 109.332 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -88.13 -29.33 20.66 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.73 -1.231 . . . . 0.0 110.915 179.116 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.6 m -65.9 -51.66 56.71 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.835 -1.166 . . . . 0.0 110.487 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.6 tpt -66.59 -39.75 88.56 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.178 -179.509 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.431 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 6.7 m-85 -72.87 -30.56 64.08 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.792 179.191 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -67.75 -36.71 81.03 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.918 -1.114 . . . . 0.0 109.639 178.784 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -39.87 86.73 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.045 -1.034 . . . . 0.0 109.82 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -59.08 -43.39 91.8 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.248 179.351 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.82 -34.67 69.92 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.194 -0.941 . . . . 0.0 109.484 178.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 6.9 ttm105 -103.78 30.77 4.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.399 179.037 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.024 0 O-C-N 120.917 -1.115 . . . . 0.0 109.945 179.643 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 120.733 0.302 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.401 HD11 HG22 ' A' ' 70' ' ' ILE . 78.9 mt 54.28 99.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.163 -0.961 . . . . 0.0 110.838 179.846 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -112.79 134.86 54.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.209 -0.932 . . . . 0.0 109.647 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 t70 53.74 -165.18 0.09 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.964 -1.085 . . . . 0.0 110.451 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.26 -176.97 3.02 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.103 -0.998 . . . . 0.0 110.218 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.414 HG23 ' CZ2' ' A' ' 79' ' ' TRP . 0.5 OUTLIER 46.73 37.3 4.54 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.154 -0.966 . . . . 0.0 111.425 -179.777 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.45 -60.05 1.9 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.599 179.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.409 HD13 ' CB ' ' A' ' 6' ' ' PHE . 1.1 pt? -143.42 62.3 1.38 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.214 -0.929 . . . . 0.0 109.772 178.681 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.41 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 12.8 pt-20 -144.92 141.26 28.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.754 -1.216 . . . . 0.0 111.002 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.02 70.12 1.24 Allowed Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.806 -1.718 . . . . 0.0 108.806 178.859 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.414 ' CZ2' HG23 ' A' ' 74' ' ' THR . 60.7 p-90 -90.7 -23.55 20.69 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.313 -1.11 . . . . 0.0 111.787 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -51.77 -32.0 29.15 Favored 'General case' 0 N--CA 1.514 2.756 0 O-C-N 120.702 -1.248 . . . . 0.0 110.768 179.741 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -83.48 -38.6 21.61 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.917 -1.115 . . . . 0.0 109.892 179.243 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.422 HD12 ' CD2' ' A' ' 10' ' ' TYR . 0.2 OUTLIER -51.76 178.63 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.84 0 O-C-N 121.062 -1.024 . . . . 0.0 110.508 -179.925 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -105.68 160.85 14.89 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.127 -0.983 . . . . 0.0 110.415 179.872 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -58.72 -39.79 81.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.272 -0.892 . . . . 0.0 110.403 -179.646 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -66.38 -42.41 87.99 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.249 -0.907 . . . . 0.0 109.705 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 20.3 mt-10 -66.63 -39.29 88.24 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.513 -0.875 . . . . 0.0 109.416 179.234 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 16.2 ttpp -61.38 -39.08 89.35 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.843 179.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 13.6 tt0 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.165 -0.96 . . . . 0.0 110.063 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -63.8 -39.29 93.89 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.151 -0.968 . . . . 0.0 110.083 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.3 mt -67.17 -41.15 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.417 0 O-C-N 121.216 -0.928 . . . . 0.0 109.379 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 30.5 p -60.83 -38.32 85.08 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.166 -0.959 . . . . 0.0 109.802 179.437 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -57.6 -39.89 77.84 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.113 -0.992 . . . . 0.0 109.845 179.533 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.507 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.8 m-70 -60.2 -52.99 62.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.19 -0.943 . . . . 0.0 109.702 179.651 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.431 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 7.9 mt -63.28 -39.21 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 C-N-CA 119.352 -0.939 . . . . 0.0 109.414 179.46 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.02 -41.14 91.37 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.179 -0.95 . . . . 0.0 109.219 178.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -71.07 -42.6 69.19 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.201 -0.937 . . . . 0.0 108.703 178.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.5 tp -62.53 -34.11 76.25 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.323 -0.861 . . . . 0.0 109.974 178.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.4 t -96.92 52.66 1.18 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.115 -0.991 . . . . 0.0 110.165 179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 N--CA 1.493 1.704 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.911 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.7 156.67 37.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.179 -0.95 . . . . 0.0 110.395 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.511 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -147.34 136.63 22.54 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.423 -0.798 . . . . 0.0 109.915 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.3 p -152.83 160.93 43.11 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 110.027 178.957 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.423 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 6.8 m -101.98 122.57 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 120.926 -1.109 . . . . 0.0 110.612 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.71 154.99 34.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.103 -0.998 . . . . 0.0 110.223 179.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.53 149.48 27.09 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.487 -0.758 . . . . 0.0 110.075 -179.798 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -111.16 126.29 54.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.244 -0.91 . . . . 0.0 110.127 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -116.61 -56.18 2.3 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.262 -0.899 . . . . 0.0 110.277 -179.916 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -117.39 93.18 4.07 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.156 -0.965 . . . . 0.0 110.307 -179.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.44 126.74 2.29 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.2 p -115.58 145.59 42.53 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.202 -1.175 . . . . 0.0 110.07 179.881 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.92 145.54 28.66 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.195 -0.941 . . . . 0.0 110.879 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.34 130.44 47.7 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . 1.002 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 31.1 p -69.6 117.13 10.82 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.28 -1.129 . . . . 0.0 111.014 -178.722 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 11.8 mmtt -64.59 157.28 27.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.15 -0.969 . . . . 0.0 109.547 179.849 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.52 18.42 11.05 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.519 -1.363 . . . . 0.0 111.395 -178.909 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 1.002 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 10.2 p -175.18 143.65 0.69 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.576 -1.328 . . . . 0.0 110.663 178.13 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.87 84.69 7.3 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.017 -1.052 . . . . 0.0 111.914 -177.861 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -163.6 -174.71 3.83 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 178.687 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.4 ttmm -129.69 156.57 44.04 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.002 -1.061 . . . . 0.0 109.983 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.4 mt -109.14 129.53 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 33.3 m -125.17 160.39 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.174 -0.954 . . . . 0.0 110.238 179.873 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -46.29 134.67 8.62 Favored 'General case' 0 N--CA 1.518 2.931 0 O-C-N 121.43 -0.794 . . . . 0.0 111.452 -179.321 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.43 10.39 44.66 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.386 -179.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.8 p -125.53 135.9 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 CA-C-N 119.667 1.733 . . . . 0.0 110.424 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 45.1 t -92.24 130.28 37.98 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.192 -0.943 . . . . 0.0 109.511 179.26 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.26 150.85 46.67 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.233 -0.917 . . . . 0.0 110.538 -179.693 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 32' ' ' ILE . 22.1 mt -101.65 129.12 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.275 -0.891 . . . . 0.0 109.644 179.747 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.423 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.63 129.67 9.93 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.258 -1.537 . . . . 0.0 109.258 179.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 11.4 ttpt -101.85 121.26 41.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.302 -1.116 . . . . 0.0 109.066 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 56.0 t -102.71 110.51 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.022 -1.049 . . . . 0.0 110.552 -179.446 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.5 t -121.32 112.09 33.15 Favored Pre-proline 0 N--CA 1.496 1.855 0 O-C-N 121.265 -0.897 . . . . 0.0 109.568 179.612 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.26 126.49 11.11 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.116 1.061 . . . . 0.0 110.451 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.3 m120 . . . . . 0 N--CA 1.499 1.982 0 O-C-N 121.252 -0.905 . . . . 0.0 110.183 179.671 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.543 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.51 148.4 37.96 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.21 -1.171 . . . . 0.0 110.105 -179.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.9 mtt -114.99 119.78 37.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.293 -0.879 . . . . 0.0 110.274 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 26.3 ttmt -116.1 127.96 55.28 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.208 -0.932 . . . . 0.0 109.988 179.829 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -114.59 124.99 53.24 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.423 ' CZ3' ' HA2' ' A' ' 33' ' ' GLY . 17.6 m95 -89.01 126.69 35.53 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.187 -0.946 . . . . 0.0 110.057 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.511 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 1.0 OUTLIER -147.21 170.46 17.2 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.527 178.68 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.431 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 57.1 m80 -74.72 179.69 4.64 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.658 -0.651 . . . . 0.0 111.217 -178.414 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.437 HG23 ' CD2' ' A' ' 93' ' ' HIS . 33.6 mm -88.57 -48.92 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 179.044 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -60.46 -38.6 84.71 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.342 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.1 m -61.69 -50.01 74.21 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.238 -0.914 . . . . 0.0 109.068 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.4 tpt -68.91 -45.49 70.76 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.729 -0.789 . . . . 0.0 109.385 179.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.415 ' CD1' HG21 ' A' ' 53' ' ' ILE . 8.9 m-85 -63.95 -30.47 71.55 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.615 178.926 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -60.43 -39.79 88.74 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.883 -1.136 . . . . 0.0 109.62 179.143 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.408 179.251 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -59.83 -42.61 93.91 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.126 -0.984 . . . . 0.0 109.173 179.23 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -58.51 -34.49 71.01 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.229 -0.92 . . . . 0.0 109.661 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -105.42 30.19 5.88 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.208 -0.932 . . . . 0.0 110.723 179.261 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 110.104 179.854 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.07 98.25 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.232 -0.917 . . . . 0.0 110.689 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -109.51 134.63 51.66 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.228 -0.92 . . . . 0.0 109.544 179.339 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.37 -165.36 0.1 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.956 -1.09 . . . . 0.0 110.203 -179.534 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.4 ' C ' ' OG1' ' A' ' 74' ' ' THR . 0.3 OUTLIER -116.16 -172.41 2.17 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.122 -0.986 . . . . 0.0 110.201 179.872 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.421 HG23 ' CZ2' ' A' ' 79' ' ' TRP . 0.7 OUTLIER 46.9 37.1 4.51 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.114 -0.992 . . . . 0.0 111.296 -179.577 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -109.81 -58.3 2.07 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.153 -0.967 . . . . 0.0 109.652 179.579 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 76' ' ' LEU . 1.2 pt? -145.23 62.2 1.29 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.093 -1.004 . . . . 0.0 109.861 178.668 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.423 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 12.4 pt-20 -143.92 140.82 29.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.8 -1.188 . . . . 0.0 110.867 179.321 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.77 70.27 0.95 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.421 ' CZ2' HG23 ' A' ' 74' ' ' THR . 61.8 p-90 -90.58 -23.4 20.86 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.23 -1.159 . . . . 0.0 111.644 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -52.47 -34.41 48.94 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.685 -1.259 . . . . 0.0 110.285 179.45 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.68 -39.03 20.71 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.088 -1.007 . . . . 0.0 109.635 178.972 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.421 HD13 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -51.12 177.21 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.046 -1.034 . . . . 0.0 110.42 179.787 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -101.31 160.56 14.31 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.137 -0.977 . . . . 0.0 110.413 179.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.7 -42.9 98.12 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.26 -0.9 . . . . 0.0 110.101 -179.888 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.69 -41.8 99.3 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.539 -0.865 . . . . 0.0 109.751 179.839 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 71.4 mt-10 -67.52 -40.56 85.1 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.523 -0.871 . . . . 0.0 109.253 179.109 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -61.3 -38.91 88.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.305 -0.872 . . . . 0.0 109.814 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.41 ' O ' ' OG1' ' A' ' 91' ' ' THR . 18.2 mm-40 -58.77 -39.75 81.93 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.258 -0.901 . . . . 0.0 109.922 179.743 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -60.52 -35.73 76.68 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.152 -0.967 . . . . 0.0 110.362 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.467 HD11 HG22 ' A' ' 90' ' ' ILE . 47.7 mm -69.28 -39.2 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.084 -1.01 . . . . 0.0 109.371 179.561 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 73.5 p -61.31 -39.18 89.52 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.023 -1.048 . . . . 0.0 109.603 179.257 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -57.61 -36.85 72.32 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.153 -0.967 . . . . 0.0 109.906 179.226 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.437 ' CD2' HG23 ' A' ' 53' ' ' ILE . 12.7 m-70 -59.37 -53.43 58.29 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.127 -0.983 . . . . 0.0 109.878 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.4 mp -63.29 -38.55 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.435 179.616 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.409 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -69.4 -37.24 77.42 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.182 -0.949 . . . . 0.0 109.9 179.198 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.73 -38.4 73.56 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.13 -0.981 . . . . 0.0 109.712 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -78.9 -32.75 45.91 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.116 -0.99 . . . . 0.0 110.315 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.8 t -96.01 54.03 1.43 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.98 -1.075 . . . . 0.0 110.193 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.409 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 5.0 m . . . . . 0 N--CA 1.494 1.767 0 O-C-N 121.126 -0.984 . . . . 0.0 110.227 179.859 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 . . . . . 0 N--CA 1.494 1.746 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.22 145.04 51.05 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.948 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 34' ' ' LYS . 0.3 OUTLIER -150.24 137.6 19.66 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.286 -0.884 . . . . 0.0 109.726 -179.94 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -153.3 157.03 39.5 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.157 -0.964 . . . . 0.0 110.258 179.193 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 5.7 m -100.98 135.09 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.308 0 O-C-N 121.004 -1.06 . . . . 0.0 110.505 179.637 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.52 157.71 46.21 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.335 -0.853 . . . . 0.0 110.133 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.425 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -107.17 154.91 20.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.407 -0.808 . . . . 0.0 110.085 -179.958 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.97 133.07 37.79 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.319 -0.863 . . . . 0.0 110.061 179.76 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 -55.44 2.44 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.27 -0.894 . . . . 0.0 110.456 -179.805 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 -138.51 105.87 5.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.166 -0.959 . . . . 0.0 110.29 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.75 151.56 6.04 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 83.8 m -116.11 142.23 47.09 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.226 -1.161 . . . . 0.0 110.033 179.897 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.23 129.74 27.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.141 -0.974 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.77 122.19 25.56 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -61.24 129.91 43.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -1.151 . . . . 0.0 109.441 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 14.9 tptt -61.98 147.42 47.05 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.168 179.827 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt 52.29 48.45 22.63 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.05 -1.031 . . . . 0.0 109.776 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.5 t -164.43 155.75 15.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.342 -0.849 . . . . 0.0 110.736 -178.147 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.87 44.25 1.04 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.27 -0.894 . . . . 0.0 108.604 178.629 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.35 -174.65 4.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.447 -0.783 . . . . 0.0 110.198 -179.045 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -136.46 156.62 48.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.091 -1.006 . . . . 0.0 109.743 -179.516 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.4 mt -97.58 121.56 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.645 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.51 176.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.331 -0.855 . . . . 0.0 110.6 -179.514 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -43.64 125.88 4.26 Favored 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.784 -0.573 . . . . 0.0 111.334 -179.544 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.16 8.58 50.2 Favored Glycine 0 N--CA 1.492 2.417 0 C-N-CA 120.151 -1.023 . . . . 0.0 110.955 -179.212 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.9 t -122.07 134.45 65.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-N 119.562 1.681 . . . . 0.0 109.869 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 51.4 t -96.36 138.03 34.56 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.25 -0.906 . . . . 0.0 108.64 178.516 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.439 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 4.9 ptt85 -136.05 151.05 49.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.128 -0.982 . . . . 0.0 111.151 -178.924 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.5 mt -105.01 137.0 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.26 -0.9 . . . . 0.0 109.832 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.13 127.16 8.7 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 108.934 -1.666 . . . . 0.0 108.934 179.658 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.448 ' CE ' ' OH ' ' A' ' 51' ' ' TYR . 49.6 pttt -110.89 124.05 51.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.154 -1.203 . . . . 0.0 110.08 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -112.72 107.99 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.918 -1.114 . . . . 0.0 110.121 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -122.39 112.23 31.38 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.225 -0.922 . . . . 0.0 109.919 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.74 127.19 12.08 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.198 1.104 . . . . 0.0 110.206 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 . . . . . 0 N--CA 1.499 1.982 0 O-C-N 121.112 -0.992 . . . . 0.0 110.162 179.75 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.467 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.49 133.88 55.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.148 -1.207 . . . . 0.0 110.256 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 37.5 mtt -117.52 138.49 51.86 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.169 -0.957 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 ttmm -117.23 125.77 51.69 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.187 -0.945 . . . . 0.0 109.996 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -114.81 134.6 54.99 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.181 -0.95 . . . . 0.0 109.946 179.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.439 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 42.2 m95 -93.09 126.93 38.43 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.31 -0.869 . . . . 0.0 109.655 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.448 ' OH ' ' CE ' ' A' ' 34' ' ' LYS . 98.1 m-85 -112.2 174.66 5.77 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.289 -0.882 . . . . 0.0 110.616 -179.477 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -92.64 -172.35 3.02 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.473 HG23 ' NE2' ' A' ' 93' ' ' HIS . 35.2 mm -83.74 -41.62 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.928 178.828 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -89.13 -24.29 22.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.01 -1.056 . . . . 0.0 111.384 179.164 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 60.8 m -75.8 -41.44 52.81 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.638 -1.289 . . . . 0.0 110.198 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -36.24 67.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.399 -0.92 . . . . 0.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.427 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 11.2 m-85 -80.89 -31.69 35.13 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 119.024 -1.07 . . . . 0.0 109.737 179.089 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -78.79 -33.42 46.28 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.032 -1.042 . . . . 0.0 109.677 178.153 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -33.39 65.88 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.028 -1.045 . . . . 0.0 109.979 179.224 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 tp -75.24 -40.15 59.25 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.033 -1.042 . . . . 0.0 109.443 179.291 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -73.5 -30.28 63.03 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.219 -0.925 . . . . 0.0 110.324 178.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.75 -30.47 14.24 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.036 -1.04 . . . . 0.0 111.003 179.918 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.761 0 O-C-N 120.907 -1.121 . . . . 0.0 110.429 -179.567 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.5 tptm . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.679 0.276 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.5 mt -112.51 113.83 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.292 -0.88 . . . . 0.0 109.66 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -110.48 155.04 22.79 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.185 -0.947 . . . . 0.0 110.391 -179.777 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 50.95 -175.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.06 -1.025 . . . . 0.0 110.897 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.2 tp -125.61 37.92 4.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.281 -0.887 . . . . 0.0 110.575 -179.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.425 HG23 ' CZ2' ' A' ' 79' ' ' TRP . 0.6 OUTLIER -145.64 39.19 1.15 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.189 -0.945 . . . . 0.0 110.306 179.661 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -109.75 -58.61 2.03 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.204 -0.935 . . . . 0.0 109.581 179.452 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.411 ' N ' ' CD2' ' A' ' 76' ' ' LEU . 1.3 pt? -145.28 62.69 1.29 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.235 -0.916 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.416 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 0.7 OUTLIER -145.86 141.0 27.45 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.902 -1.124 . . . . 0.0 111.062 179.394 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.89 69.24 2.45 Favored Glycine 0 N--CA 1.496 2.675 0 N-CA-C 108.943 -1.663 . . . . 0.0 108.943 179.227 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.425 ' CZ2' HG23 ' A' ' 74' ' ' THR . 61.7 p-90 -89.08 -23.49 22.51 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.248 -1.148 . . . . 0.0 111.783 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -52.12 -33.55 40.41 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.581 -1.324 . . . . 0.0 110.692 179.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.73 -38.43 28.77 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.953 -1.092 . . . . 0.0 109.817 179.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.403 ' CD2' ' CD1' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -50.88 177.58 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.139 -0.976 . . . . 0.0 110.686 -179.991 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -102.75 160.45 14.58 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.122 -0.986 . . . . 0.0 110.355 179.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -60.94 -43.5 98.6 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.259 -0.9 . . . . 0.0 110.177 -179.819 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -61.27 -50.57 72.49 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.27 -0.893 . . . . 0.0 109.56 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.425 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 1.2 mp0 -62.92 -41.04 99.34 Favored 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.157 178.975 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.09 -38.46 82.98 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.35 -0.844 . . . . 0.0 110.005 179.324 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.84 -39.14 93.09 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.227 -0.92 . . . . 0.0 110.065 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -39.82 87.69 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.103 -0.998 . . . . 0.0 110.006 179.791 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . 0.403 ' CD1' ' CD2' ' A' ' 82' ' ' LEU . 13.6 mt -66.13 -39.73 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.197 -0.939 . . . . 0.0 109.395 179.45 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.49 -37.9 79.46 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.171 -0.956 . . . . 0.0 109.955 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -58.29 -39.86 80.41 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.194 -0.942 . . . . 0.0 109.814 179.454 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.473 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.84 -50.83 72.52 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.178 -0.951 . . . . 0.0 110.076 179.813 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . 0.427 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 4.1 mt -58.88 -38.4 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.18 -0.95 . . . . 0.0 110.015 179.851 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.65 -38.89 86.32 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.164 -0.96 . . . . 0.0 109.681 179.276 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -59.81 -46.2 89.98 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.168 -0.958 . . . . 0.0 109.596 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.4 mp -57.21 -34.26 68.36 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.116 -0.99 . . . . 0.0 110.381 179.589 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.2 m -97.93 51.41 1.04 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.03 -1.044 . . . . 0.0 110.095 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.945 . . . . 0.0 110.1 179.926 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -117.51 146.84 43.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.138 -0.976 . . . . 0.0 110.329 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.449 ' CE2' ' CD ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -140.28 136.82 33.68 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.317 -0.864 . . . . 0.0 109.88 -179.882 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 m -151.74 160.85 43.44 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.198 -0.939 . . . . 0.0 110.056 178.942 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.415 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -101.41 120.9 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.996 -1.065 . . . . 0.0 110.638 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -114.24 146.85 39.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.207 -0.933 . . . . 0.0 109.445 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.428 ' OH ' ' HB2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -100.22 147.16 26.03 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.854 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.99 128.18 34.37 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.008 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -151.77 38.02 0.59 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.176 -0.952 . . . . 0.0 110.77 179.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.58 50.82 0.18 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.183 -0.948 . . . . 0.0 110.887 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.41 -147.88 16.92 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -133.42 149.17 51.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.27 -1.136 . . . . 0.0 110.333 -179.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.4 132.09 45.6 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.206 -0.934 . . . . 0.0 110.678 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.73 121.9 28.17 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 179.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.8 t -62.78 137.54 58.29 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.324 -1.103 . . . . 0.0 110.298 -179.334 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -88.48 152.84 21.61 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 177.596 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.71 33.18 18.11 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.862 -1.149 . . . . 0.0 109.824 -178.413 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 150.78 0.35 Allowed 'General case' 0 N--CA 1.517 2.893 0 O-C-N 120.827 -1.17 . . . . 0.0 109.373 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -93.96 67.58 3.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.155 -0.965 . . . . 0.0 109.773 179.793 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -149.86 -176.27 5.36 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.256 -0.902 . . . . 0.0 110.403 -179.366 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -132.67 150.9 52.09 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.952 -1.092 . . . . 0.0 109.881 -179.236 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 13.4 mt -104.21 98.29 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.361 -0.837 . . . . 0.0 109.167 179.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 49.0 t -85.19 157.61 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 O-C-N 121.305 -0.872 . . . . 0.0 110.514 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -51.3 123.56 9.88 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.261 -0.899 . . . . 0.0 110.725 -179.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.19 -18.15 10.38 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 119.937 -1.125 . . . . 0.0 111.363 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.9 135.02 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 CA-C-N 119.584 1.692 . . . . 0.0 110.367 -179.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.42 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.4 p -79.55 131.65 36.08 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.934 179.851 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.4 ptt-85 -132.81 149.71 52.24 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.278 -0.889 . . . . 0.0 110.091 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.428 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 17.5 mt -106.25 130.8 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.151 -0.968 . . . . 0.0 109.841 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.46 138.43 14.25 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.406 -1.878 . . . . 0.0 108.406 179.225 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.449 ' CD ' ' CE2' ' A' ' 6' ' ' PHE . 9.0 ttpt -107.15 108.96 20.67 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.184 -1.186 . . . . 0.0 109.469 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.7 t -85.83 119.64 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.054 -1.029 . . . . 0.0 110.383 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 60.9 t -121.41 112.04 33.04 Favored Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.24 -0.912 . . . . 0.0 109.873 179.822 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.84 134.33 21.59 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 O-C-N 123.141 1.074 . . . . 0.0 110.544 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 N--CA 1.499 1.994 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 179.698 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.633 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -114.94 133.23 56.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -1.165 . . . . 0.0 109.922 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.6 mmt -117.3 144.41 44.9 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.182 -0.949 . . . . 0.0 110.523 -179.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -139.84 139.0 36.22 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.357 -0.839 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -111.04 130.91 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.192 -0.942 . . . . 0.0 109.6 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.424 ' CZ3' ' HA2' ' A' ' 33' ' ' GLY . 7.8 m95 -89.91 113.54 25.18 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.19 -0.944 . . . . 0.0 109.627 179.768 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.443 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -137.5 168.3 19.93 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.787 -1.165 . . . . 0.0 111.4 178.977 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -71.89 158.15 36.56 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.57 -0.706 . . . . 0.0 109.769 -179.151 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.449 ' CG2' ' CD1' ' A' ' 57' ' ' PHE . 51.1 mt -61.67 -44.58 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.264 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -31.4 65.57 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.253 -0.905 . . . . 0.0 110.552 179.461 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.4 m -70.76 -41.08 72.22 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.024 -1.048 . . . . 0.0 109.749 179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.9 tpt -76.31 -40.58 51.14 Favored 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.964 178.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CD1' ' CG2' ' A' ' 53' ' ' ILE . 7.5 m-85 -64.68 -33.27 75.56 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.543 178.507 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -58.15 -39.6 79.22 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.986 -1.071 . . . . 0.0 109.833 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.5 tttp -63.61 -40.08 95.99 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.585 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.95 -42.67 85.45 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.095 -1.003 . . . . 0.0 109.251 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.0 -35.46 73.28 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.234 -0.916 . . . . 0.0 109.327 178.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -105.78 31.53 4.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.838 0 O-C-N 120.902 -1.124 . . . . 0.0 110.013 179.958 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 120.97 0.414 . . . . 0.0 110.803 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.435 HD11 HG22 ' A' ' 70' ' ' ILE . 77.9 mt 52.87 99.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.187 -0.946 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.2 139.6 48.64 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 108.865 178.688 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 55.42 -163.74 0.14 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.948 -1.095 . . . . 0.0 109.712 -179.249 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.6 tt -106.49 -51.13 3.0 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.925 -1.109 . . . . 0.0 110.685 -179.845 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.73 77.43 7.58 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.097 -1.002 . . . . 0.0 110.167 -179.829 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -138.65 -58.61 0.62 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.131 -0.98 . . . . 0.0 110.499 179.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.416 ' N ' ' CD2' ' A' ' 76' ' ' LEU . 1.5 pt? -147.62 60.05 1.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.972 -1.08 . . . . 0.0 110.805 179.208 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.415 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 10.0 pt-20 -145.2 140.71 28.09 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.81 -1.181 . . . . 0.0 110.71 178.42 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.27 69.33 1.67 Allowed Glycine 0 N--CA 1.497 2.709 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 60.1 p-90 -91.47 -38.41 12.57 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.172 -1.193 . . . . 0.0 110.557 179.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -53.86 -28.3 35.21 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.08 -1.013 . . . . 0.0 111.261 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -91.19 -36.22 14.07 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.872 -1.143 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.08 -173.93 0.56 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.989 -1.07 . . . . 0.0 109.848 -179.939 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.34 161.45 30.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.178 -0.952 . . . . 0.0 110.575 -179.562 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -77.6 -36.35 51.97 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.24 -0.912 . . . . 0.0 110.278 179.599 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -52.25 -37.53 55.55 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.989 -1.07 . . . . 0.0 110.126 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.428 ' HB2' ' OH ' ' A' ' 10' ' ' TYR . 0.7 OUTLIER -57.98 -40.57 80.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.205 -0.934 . . . . 0.0 109.311 178.812 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -37.53 64.9 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.325 -0.859 . . . . 0.0 109.984 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.402 ' O ' ' OG1' ' A' ' 91' ' ' THR . 3.0 tp10 -69.0 -41.42 77.84 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.257 -0.902 . . . . 0.0 109.27 179.139 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -64.95 -36.32 84.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.229 -0.919 . . . . 0.0 110.022 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.94 -41.1 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 67.8 p -60.15 -38.77 84.15 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.112 -0.992 . . . . 0.0 110.105 179.986 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -58.42 -38.51 77.57 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.214 -0.929 . . . . 0.0 110.061 179.694 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 8.0 m-70 -65.18 -53.52 43.54 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.552 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.77 -34.73 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.25 179.004 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.406 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -71.3 -39.38 71.49 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.148 -0.97 . . . . 0.0 109.55 179.111 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.54 -37.85 85.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 109.663 179.244 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.6 tp -78.85 -29.74 44.76 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.154 -0.966 . . . . 0.0 110.718 179.461 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -103.6 39.39 1.61 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.871 -1.143 . . . . 0.0 110.49 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 22.3 m . . . . . 0 N--CA 1.5 2.029 0 O-C-N 121.146 -0.971 . . . . 0.0 110.608 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mmt . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.99 93.88 4.2 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.22 -0.925 . . . . 0.0 110.242 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -119.11 112.82 20.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.177 -0.952 . . . . 0.0 110.192 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -127.4 128.51 45.95 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.188 -0.945 . . . . 0.0 110.251 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.79 126.37 52.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.184 -0.948 . . . . 0.0 110.145 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.415 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.7 m-85 -120.77 142.8 49.22 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.27 -0.894 . . . . 0.0 110.186 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.4 m -133.96 158.92 42.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.2 -0.937 . . . . 0.0 110.158 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.4 t -116.81 125.76 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.149 -0.969 . . . . 0.0 110.05 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -142.61 158.46 43.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.147 -0.971 . . . . 0.0 110.668 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.446 ' OH ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -106.84 148.51 28.45 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.462 -0.774 . . . . 0.0 110.026 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.71 135.89 57.79 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.218 -0.927 . . . . 0.0 109.809 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -114.32 -56.44 2.39 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 110.291 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -153.36 130.97 11.48 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.181 -0.949 . . . . 0.0 110.655 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.85 158.19 23.43 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.0 p -118.14 136.98 53.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.208 -1.172 . . . . 0.0 110.063 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -129.07 132.17 47.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.126 -0.984 . . . . 0.0 110.483 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.01 111.27 3.96 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.9 t -65.15 157.76 27.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.26 -1.141 . . . . 0.0 109.182 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -87.63 155.54 19.9 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.584 -0.697 . . . . 0.0 110.197 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.54 28.26 4.64 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.266 -0.896 . . . . 0.0 111.914 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 p -172.1 163.82 6.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.787 -1.195 . . . . 0.0 111.295 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.74 53.64 0.86 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -136.03 -174.63 3.72 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.481 -0.762 . . . . 0.0 110.355 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.6 pttt -139.05 156.44 47.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.405 HD12 HG22 ' A' ' 25' ' ' ILE . 41.3 mt -95.52 105.32 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.368 -0.833 . . . . 0.0 109.564 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.4 t -108.57 162.75 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.241 -0.912 . . . . 0.0 109.931 -179.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -41.07 126.22 2.55 Favored 'General case' 0 N--CA 1.52 3.057 0 O-C-N 121.668 -0.645 . . . . 0.0 111.548 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 110.3 -3.84 29.78 Favored Glycine 0 N--CA 1.492 2.392 0 C-N-CA 120.111 -1.042 . . . . 0.0 111.125 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.1 t -110.48 134.12 53.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-N 119.564 1.682 . . . . 0.0 109.871 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.8 t -89.88 132.54 35.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.246 -0.909 . . . . 0.0 108.861 178.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.86 151.99 50.68 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.145 -0.972 . . . . 0.0 111.308 -178.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 38.5 mt -103.71 139.59 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.419 -0.801 . . . . 0.0 109.078 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.17 128.1 9.41 Favored Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 29.7 tttt -110.41 114.96 28.81 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.277 -1.131 . . . . 0.0 109.738 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -98.72 107.76 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.199 -0.938 . . . . 0.0 110.419 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.3 p -124.69 143.14 42.64 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.268 -0.895 . . . . 0.0 109.934 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -76.11 127.56 10.02 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.261 1.137 . . . . 0.0 110.292 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -104.35 116.69 60.84 Favored Pre-proline 0 N--CA 1.499 2.012 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -75.06 76.81 3.31 Favored 'Trans proline' 0 N--CA 1.484 0.946 0 O-C-N 123.122 1.064 . . . . 0.0 110.242 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -149.81 -58.34 0.2 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.186 -0.946 . . . . 0.0 110.59 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.3 t -107.94 158.9 16.96 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.169 -0.957 . . . . 0.0 110.262 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -90.33 -37.61 13.92 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.172 -0.955 . . . . 0.0 110.336 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.9 t -72.21 -40.27 67.96 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.005 -1.06 . . . . 0.0 109.877 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -85.51 77.17 2.1 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.76 -79.07 0.14 Allowed Glycine 0 N--CA 1.493 2.454 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -116.46 137.28 52.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.186 -1.185 . . . . 0.0 110.166 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.3 ttt -116.97 152.28 34.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.234 -0.917 . . . . 0.0 110.244 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -125.03 145.16 50.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.266 -0.896 . . . . 0.0 110.617 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.28 156.62 43.7 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.0 109.652 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -101.55 142.3 33.13 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.15 -0.968 . . . . 0.0 110.127 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -121.3 174.14 6.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.314 -0.866 . . . . 0.0 110.718 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.8 m80 -93.65 -173.82 3.29 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.518 HG23 ' NE2' ' A' ' 93' ' ' HIS . 45.5 mm -83.27 -33.73 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.32 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -90.57 -33.89 15.71 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.771 -1.206 . . . . 0.0 110.686 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.2 m -63.24 -52.31 62.67 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.927 -1.108 . . . . 0.0 110.307 -179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.1 88.96 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.275 -0.891 . . . . 0.0 110.375 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.418 ' CE1' HG13 ' A' ' 94' ' ' ILE . 10.4 m-85 -75.17 -30.35 60.7 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.02 -1.072 . . . . 0.0 109.751 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -68.23 -36.18 79.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.981 -1.074 . . . . 0.0 109.564 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 41.2 tttm -59.97 -40.05 87.74 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.996 . . . . 0.0 109.761 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -59.89 -44.91 93.97 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.738 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -58.56 -35.1 71.84 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.212 -0.93 . . . . 0.0 110.436 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 ttt-85 -89.71 -29.2 18.91 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.18 -0.95 . . . . 0.0 111.01 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.15 167.64 1.66 Allowed 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.826 -1.171 . . . . 0.0 110.186 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.9 mmm-85 -63.87 156.83 26.35 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.189 -0.945 . . . . 0.0 110.324 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.31 -33.46 22.09 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.317 -0.865 . . . . 0.0 110.655 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -49.9 -35.22 22.84 Favored 'General case' 0 N--CA 1.515 2.785 0 O-C-N 120.929 -1.107 . . . . 0.0 111.035 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.89 128.09 53.55 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.062 -1.024 . . . . 0.0 109.859 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -114.75 143.32 45.26 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.192 -0.942 . . . . 0.0 110.424 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.9 mtpt -126.62 149.78 49.29 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.202 -0.936 . . . . 0.0 109.999 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.413 HG22 HD11 ' A' ' 70' ' ' ILE . 79.4 mt 54.36 98.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.116 -0.99 . . . . 0.0 110.562 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -110.29 141.77 42.84 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.139 -0.976 . . . . 0.0 110.02 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -165.56 0.08 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.056 -1.027 . . . . 0.0 110.516 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.423 HD21 ' OG1' ' A' ' 91' ' ' THR . 15.9 tp -114.72 37.64 3.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.139 -0.975 . . . . 0.0 110.508 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -152.96 36.74 0.49 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.067 -1.021 . . . . 0.0 110.8 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -125.35 38.81 4.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.119 -0.988 . . . . 0.0 109.776 179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -147.82 153.67 39.48 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.213 -0.93 . . . . 0.0 110.109 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -89.95 97.67 11.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.116 -0.99 . . . . 0.0 110.065 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.19 -35.25 0.84 Allowed Glycine 0 N--CA 1.495 2.63 0 C-N-CA 119.724 -1.227 . . . . 0.0 110.963 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.448 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 27.2 p-90 -52.09 -30.66 27.07 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.006 1.403 . . . . 0.0 111.062 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.448 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.6 tm-20 -60.0 -42.98 95.46 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 120.907 -1.121 . . . . 0.0 109.684 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.31 -39.46 90.58 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.172 -0.955 . . . . 0.0 109.816 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.6 mp -49.93 173.72 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.855 0 O-C-N 121.17 -0.956 . . . . 0.0 110.759 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -107.13 161.85 14.39 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.178 -0.951 . . . . 0.0 110.388 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.19 -43.9 74.82 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.132 -0.98 . . . . 0.0 110.481 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -62.43 -51.15 68.67 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.262 -0.899 . . . . 0.0 109.43 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.446 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 0.6 OUTLIER -62.19 -38.88 90.8 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.297 -0.877 . . . . 0.0 109.331 179.031 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 24.3 tttt -59.43 -39.19 82.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.233 -0.917 . . . . 0.0 109.775 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -59.99 -40.0 87.64 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.715 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.12 -38.94 92.86 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.219 -0.926 . . . . 0.0 110.019 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.465 HG22 HD11 ' A' ' 90' ' ' ILE . 45.9 mm -68.45 -41.51 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.152 -0.967 . . . . 0.0 109.026 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.423 ' OG1' HD21 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -60.55 -38.17 83.62 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.23 -0.919 . . . . 0.0 109.935 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -58.93 -40.23 83.97 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.149 -0.97 . . . . 0.0 109.991 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.518 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.3 m-70 -59.93 -47.61 85.08 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.206 -0.934 . . . . 0.0 109.933 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.418 HG13 ' CE1' ' A' ' 57' ' ' PHE . 19.4 mt -63.67 -39.25 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.202 -0.936 . . . . 0.0 109.61 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.03 95.83 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.216 -0.927 . . . . 0.0 109.438 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.24 -40.44 67.71 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.229 -0.919 . . . . 0.0 109.088 178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.1 tp -68.45 -33.12 73.62 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.196 -0.94 . . . . 0.0 110.228 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.7 t -93.96 -58.81 2.13 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.945 -1.097 . . . . 0.0 110.007 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m 52.42 -164.9 0.07 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.04 -1.037 . . . . 0.0 110.89 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 53.65 80.06 0.12 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.069 -1.019 . . . . 0.0 110.704 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -116.98 -57.08 2.2 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.248 -0.907 . . . . 0.0 110.114 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -124.91 -65.46 1.03 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.235 -0.916 . . . . 0.0 110.212 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -141.2 66.72 0.49 Allowed Glycine 0 N--CA 1.494 2.545 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 8.1 t -155.42 58.43 1.89 Allowed Pre-proline 0 N--CA 1.498 1.965 0 O-C-N 121.167 -1.196 . . . . 0.0 110.719 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.4 108.51 2.53 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 123.288 1.152 . . . . 0.0 110.45 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.7 mtpt -129.84 146.78 51.57 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.202 -0.936 . . . . 0.0 110.212 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -142.81 141.16 31.59 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.195 -0.94 . . . . 0.0 110.223 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 52.4 81.76 0.08 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.051 -1.031 . . . . 0.0 110.838 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -133.12 119.13 19.55 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.201 -0.937 . . . . 0.0 110.246 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.5 146.35 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.223 -0.923 . . . . 0.0 110.191 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.12 142.95 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.256 -0.903 . . . . 0.0 110.261 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -118.35 105.48 11.76 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.204 -0.935 . . . . 0.0 110.286 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.92 136.89 53.19 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.188 -0.945 . . . . 0.0 110.261 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 27.5 mmtt -122.84 110.14 15.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.209 -0.932 . . . . 0.0 110.243 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.7 mp -117.74 136.47 53.35 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.18 -0.95 . . . . 0.0 110.217 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 37.6 p -119.63 142.56 48.32 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 110.239 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.217 179.982 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 110.191 -0.299 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.95 119.16 33.48 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.194 -0.942 . . . . 0.0 110.208 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -124.22 92.54 3.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.197 -0.94 . . . . 0.0 110.171 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -127.57 159.38 34.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.23 -0.919 . . . . 0.0 110.228 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -119.82 138.44 53.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.264 -0.898 . . . . 0.0 110.205 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.424 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 1.9 m-85 -118.21 150.06 40.04 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.219 -0.925 . . . . 0.0 110.284 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.9 m -134.15 156.39 48.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.262 -0.899 . . . . 0.0 110.032 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 52.6 t -109.82 135.54 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.118 -0.989 . . . . 0.0 110.028 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -148.35 153.58 38.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.185 -0.947 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -110.87 148.44 32.42 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.41 -0.807 . . . . 0.0 109.549 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.29 130.92 41.91 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.514 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -138.05 -65.68 0.51 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.171 -0.956 . . . . 0.0 110.432 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -116.98 110.87 18.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.214 -0.929 . . . . 0.0 110.318 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.18 142.34 10.49 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 5.4 m -116.26 135.88 53.5 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.205 -1.174 . . . . 0.0 110.048 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.28 144.51 31.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.182 -0.949 . . . . 0.0 110.51 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.7 156.34 53.35 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -91.83 143.86 26.08 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.211 -1.17 . . . . 0.0 108.726 179.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CB ' ' CE2' ' A' ' 51' ' ' TYR . 4.3 mmtt -52.91 147.32 9.32 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 120.86 -1.15 . . . . 0.0 110.311 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt 53.28 62.01 2.87 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.137 -0.977 . . . . 0.0 110.242 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.3 t -172.49 148.7 2.04 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.917 -1.114 . . . . 0.0 111.913 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -107.45 45.99 0.97 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -132.51 -171.84 2.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.591 -0.693 . . . . 0.0 109.956 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -135.3 153.09 51.99 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.026 -1.047 . . . . 0.0 110.535 -179.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 72.0 mt -107.01 112.88 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.371 -0.83 . . . . 0.0 109.6 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 13.4 p -111.11 161.19 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.195 -0.941 . . . . 0.0 110.609 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 1.6 ptpp? -46.22 120.24 2.7 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 121.437 -0.79 . . . . 0.0 111.282 -179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 125.22 -22.0 6.37 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.999 -1.096 . . . . 0.0 111.004 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.9 m -100.69 138.21 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 CA-C-N 119.342 1.571 . . . . 0.0 110.52 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 42.4 t -82.66 141.96 32.08 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.233 -0.917 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.43 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 3.5 ptt85 -138.19 150.41 46.73 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.325 -0.859 . . . . 0.0 110.174 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.1 mt -105.62 144.25 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.293 -0.879 . . . . 0.0 109.98 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.89 132.13 10.99 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.424 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 27.5 ttpt -116.36 115.33 25.69 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.095 -1.238 . . . . 0.0 110.066 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.0 t -102.12 111.13 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.158 -0.964 . . . . 0.0 110.436 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.8 p -122.51 143.4 39.63 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.195 -0.94 . . . . 0.0 110.257 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -78.38 150.03 24.99 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 O-C-N 123.123 1.065 . . . . 0.0 110.634 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 -102.9 162.76 19.15 Favored Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 121.306 -0.872 . . . . 0.0 110.108 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.13 105.66 1.88 Allowed 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.386 1.203 . . . . 0.0 110.218 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.5 t80 55.26 100.11 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.136 -0.977 . . . . 0.0 110.574 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.5 m -116.94 134.8 54.29 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.119 -0.988 . . . . 0.0 110.197 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -102.26 -48.58 4.15 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.171 -0.955 . . . . 0.0 110.358 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.8 m -88.83 -41.18 12.64 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.17 -0.956 . . . . 0.0 110.256 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -113.82 -170.02 17.06 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.719 -1.352 . . . . 0.0 109.719 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.93 -59.69 0.01 OUTLIER Glycine 0 N--CA 1.497 2.734 0 N-CA-C 109.824 -1.311 . . . . 0.0 109.824 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -114.57 152.71 31.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.192 -1.181 . . . . 0.0 110.037 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.0 mmt -112.56 124.97 53.73 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.276 -0.89 . . . . 0.0 110.35 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -117.7 122.27 43.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.213 -0.929 . . . . 0.0 110.147 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -127.44 152.21 47.83 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.194 -0.942 . . . . 0.0 109.85 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.43 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 72.1 m95 -98.83 141.93 30.99 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.234 -0.916 . . . . 0.0 110.081 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CE2' ' CB ' ' A' ' 19' ' ' LYS . 96.0 m-85 -120.73 174.25 6.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.304 -0.873 . . . . 0.0 110.465 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -95.24 -173.12 2.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.502 HG23 ' NE2' ' A' ' 93' ' ' HIS . 40.9 mm -87.16 -37.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.051 -1.031 . . . . 0.0 109.263 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -88.99 -27.95 20.54 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.887 -1.133 . . . . 0.0 110.821 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 65.7 m -71.58 -49.15 43.14 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.966 -1.084 . . . . 0.0 109.911 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.35 -37.34 83.09 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.36 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.422 ' CE1' HG13 ' A' ' 94' ' ' ILE . 5.9 m-85 -74.33 -32.8 62.96 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 118.952 -1.099 . . . . 0.0 109.588 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -63.37 -36.74 84.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.49 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -59.9 -40.02 87.35 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.135 -0.978 . . . . 0.0 109.779 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -58.11 -45.28 87.52 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.179 -0.95 . . . . 0.0 109.262 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -59.56 -36.07 75.47 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 119.574 -0.851 . . . . 0.0 109.407 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -108.61 32.3 4.96 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.311 -0.868 . . . . 0.0 110.368 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.98 168.39 9.52 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.909 -1.119 . . . . 0.0 110.22 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.5 mtt-85 -74.57 157.02 36.18 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.254 -0.904 . . . . 0.0 110.129 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.78 -33.73 22.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.271 -0.893 . . . . 0.0 110.603 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.6 p -50.41 -35.3 27.83 Favored 'General case' 0 N--CA 1.515 2.79 0 O-C-N 120.94 -1.1 . . . . 0.0 111.024 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 37.3 m -108.33 136.89 47.21 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.137 -0.977 . . . . 0.0 110.014 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.8 tptt -117.08 144.3 44.82 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.216 -0.928 . . . . 0.0 110.379 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -129.96 139.42 51.08 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.114 -0.991 . . . . 0.0 110.161 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.2 mt 55.18 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.202 -0.936 . . . . 0.0 110.791 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -108.91 141.45 40.96 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.197 -0.94 . . . . 0.0 109.961 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 53.17 -173.06 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.987 -1.071 . . . . 0.0 110.677 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.444 ' CD2' ' OG1' ' A' ' 91' ' ' THR . 14.1 tp -98.39 -35.53 10.26 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.178 -0.951 . . . . 0.0 111.102 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -102.8 50.23 0.82 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.918 -1.114 . . . . 0.0 110.446 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -125.5 38.17 4.22 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.196 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.417 ' O ' ' CD1' ' A' ' 79' ' ' TRP . 48.4 mt -145.48 155.2 42.96 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.216 -0.927 . . . . 0.0 110.135 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -84.46 97.69 9.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.055 -1.028 . . . . 0.0 110.277 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.72 -37.32 0.62 Allowed Glycine 0 N--CA 1.497 2.736 0 C-N-CA 119.689 -1.243 . . . . 0.0 111.036 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.451 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 34.8 p-90 -55.22 -33.3 62.96 Favored 'General case' 0 N--CA 1.513 2.717 0 O-C-N 120.872 -1.369 . . . . 0.0 110.728 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.451 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.2 tt0 -54.18 -39.48 66.65 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.91 -1.119 . . . . 0.0 110.243 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -72.25 -36.43 69.07 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.212 -0.93 . . . . 0.0 110.02 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.416 HD13 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -53.25 -179.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.793 0 O-C-N 121.104 -0.998 . . . . 0.0 110.343 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -106.76 161.07 14.99 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.12 -0.987 . . . . 0.0 110.33 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.41 -39.94 81.12 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.391 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -66.23 -42.3 88.83 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.585 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -66.73 -39.89 88.16 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.539 -0.864 . . . . 0.0 109.359 179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.8 mtpt -60.54 -38.38 84.29 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.265 -0.897 . . . . 0.0 109.9 179.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.02 -40.36 84.74 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.879 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.44 -40.19 96.49 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.0 mt -65.38 -40.79 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.235 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.444 ' OG1' ' CD2' ' A' ' 73' ' ' LEU . 0.9 OUTLIER -59.22 -38.76 80.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.177 -0.952 . . . . 0.0 109.958 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -39.94 80.52 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.283 -0.886 . . . . 0.0 109.897 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.502 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.5 m-70 -58.35 -47.39 83.93 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.135 -0.978 . . . . 0.0 109.846 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.422 HG13 ' CE1' ' A' ' 57' ' ' PHE . 26.0 mt -66.12 -38.23 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.241 -0.912 . . . . 0.0 109.511 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.43 81.1 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.127 -0.983 . . . . 0.0 109.386 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.46 -41.89 68.84 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.217 -0.927 . . . . 0.0 108.836 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.5 tp -71.0 -33.64 70.6 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.345 -0.847 . . . . 0.0 109.815 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 41.3 m -100.67 46.73 0.94 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.968 -1.082 . . . . 0.0 110.075 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.5 t -120.37 139.16 53.2 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.174 -0.954 . . . . 0.0 110.368 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -144.89 48.98 1.3 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.231 -0.918 . . . . 0.0 110.29 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -141.67 56.97 1.5 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.154 -0.966 . . . . 0.0 110.281 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.08 57.65 1.27 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.022 -1.049 . . . . 0.0 110.302 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -140.52 -94.39 0.25 Allowed Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.422 ' OG1' ' HD3' ' A' ' 105' ' ' PRO . 0.0 OUTLIER -63.91 -57.83 17.15 Favored Pre-proline 0 N--CA 1.508 2.456 0 O-C-N 121.192 -1.181 . . . . 0.0 110.195 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.422 ' HD3' ' OG1' ' A' ' 104' ' ' THR . 47.5 Cg_endo -73.5 134.31 20.35 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.28 1.147 . . . . 0.0 110.43 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -128.99 170.15 13.81 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.15 -0.969 . . . . 0.0 110.245 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? 53.19 179.91 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.007 -1.058 . . . . 0.0 110.756 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -152.38 -174.12 4.78 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.212 -0.93 . . . . 0.0 110.675 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.07 161.87 18.24 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.213 -0.929 . . . . 0.0 110.242 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.0 t -123.51 106.55 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.167 -0.958 . . . . 0.0 110.041 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.8 m -138.08 142.29 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.2 -0.937 . . . . 0.0 110.266 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -132.07 141.93 49.36 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.12 -0.988 . . . . 0.0 110.172 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.41 105.49 10.56 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.24 -0.912 . . . . 0.0 110.268 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.6 tptt -121.21 147.44 45.61 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.263 -0.898 . . . . 0.0 110.273 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.2 tp -117.99 139.42 51.2 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.116 -0.99 . . . . 0.0 110.241 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.2 m -124.71 140.46 52.91 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.223 -0.923 . . . . 0.0 110.241 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.201 -180.0 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.6 mtt . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.94 86.77 2.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 110.231 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -131.79 164.14 26.67 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.147 -0.97 . . . . 0.0 110.203 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -116.23 135.55 53.8 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.186 -0.946 . . . . 0.0 110.111 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.06 121.65 32.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.197 -0.939 . . . . 0.0 110.308 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.413 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 0.6 OUTLIER -112.5 144.49 41.87 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.171 -0.955 . . . . 0.0 109.722 179.687 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.7 p -135.65 164.62 27.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.899 . . . . 0.0 110.177 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 34.1 m -125.26 140.77 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.173 -0.955 . . . . 0.0 110.955 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -146.78 97.4 2.9 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.146 -0.971 . . . . 0.0 110.163 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.43 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 7.3 m-85 -54.06 154.61 4.09 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.188 -0.945 . . . . 0.0 110.456 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -108.32 131.21 54.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.279 -0.888 . . . . 0.0 110.696 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -117.09 -57.81 2.12 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.242 -0.911 . . . . 0.0 109.912 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.7 mtm-85 -119.12 159.43 23.97 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.242 -0.912 . . . . 0.0 110.02 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.64 162.42 29.59 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.5 m -133.86 144.21 48.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.144 -1.21 . . . . 0.0 110.322 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -135.77 143.42 45.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.737 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -74.37 123.51 7.78 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 11.0 t -62.35 130.61 46.05 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.272 -1.134 . . . . 0.0 109.412 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -61.89 147.8 45.54 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.173 -0.954 . . . . 0.0 109.209 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? 52.87 46.88 25.87 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.994 -1.066 . . . . 0.0 109.567 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.2 t -165.59 153.93 11.36 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.343 -0.848 . . . . 0.0 110.944 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -105.38 44.66 1.02 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -138.7 -175.03 4.0 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.464 -0.772 . . . . 0.0 109.978 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.56 157.24 46.18 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.203 -0.935 . . . . 0.0 110.06 -179.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.416 HG12 ' CD2' ' A' ' 52' ' ' HIS . 59.7 mt -112.61 123.28 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.395 -0.816 . . . . 0.0 109.956 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.9 p -165.45 112.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.112 -0.992 . . . . 0.0 111.364 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.47 126.76 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.198 -0.939 . . . . 0.0 111.632 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.48 9.34 81.77 Favored Glycine 0 N--CA 1.496 2.652 0 O-C-N 121.077 -1.014 . . . . 0.0 111.808 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 95.1 t -126.66 135.59 63.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.708 1.754 . . . . 0.0 110.085 -179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.4 t -95.78 134.91 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.179 -0.95 . . . . 0.0 109.24 178.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 25.3 mtm180 -113.6 129.3 56.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.127 -0.983 . . . . 0.0 110.771 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.2 mt -103.81 128.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.215 -0.928 . . . . 0.0 108.515 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.9 130.52 10.27 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.413 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 21.0 tttm -107.03 113.53 27.06 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.334 -1.098 . . . . 0.0 109.393 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.7 t -96.72 112.76 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.142 -0.973 . . . . 0.0 110.538 -179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.1 t -120.77 111.03 34.69 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -73.39 127.35 11.77 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.205 1.108 . . . . 0.0 110.427 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -104.26 116.9 60.57 Favored Pre-proline 0 N--CA 1.499 1.99 0 O-C-N 121.179 -0.95 . . . . 0.0 110.084 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.27 76.95 2.95 Favored 'Trans proline' 0 C--N 1.32 -0.969 0 O-C-N 123.196 1.103 . . . . 0.0 110.282 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -147.33 -58.74 0.27 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.106 -0.996 . . . . 0.0 110.479 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -106.98 158.05 17.33 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.237 -0.915 . . . . 0.0 110.193 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -94.41 -38.84 10.76 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.255 -0.903 . . . . 0.0 110.345 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.2 p -57.37 -39.68 76.52 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.13 -0.981 . . . . 0.0 110.152 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.58 107.48 3.38 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -84.68 -70.92 1.33 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -134.58 138.87 44.94 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.235 -1.156 . . . . 0.0 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.2 mtp -117.02 149.58 40.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.173 -0.954 . . . . 0.0 110.233 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.0 pttt -129.46 144.91 51.45 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.32 -0.862 . . . . 0.0 110.534 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -122.76 148.06 45.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.147 -0.971 . . . . 0.0 109.581 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -93.99 151.07 19.8 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.104 -0.997 . . . . 0.0 110.133 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -135.03 173.22 11.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.279 -0.888 . . . . 0.0 110.414 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.416 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -96.03 -172.34 2.54 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.876 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.498 HG23 ' NE2' ' A' ' 93' ' ' HIS . 43.6 mm -84.38 -39.85 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 121.09 -1.006 . . . . 0.0 108.777 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -89.02 -25.68 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.922 -1.111 . . . . 0.0 111.081 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.7 m -75.95 -42.2 49.31 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.78 -1.2 . . . . 0.0 109.987 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -38.18 66.62 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.86 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.431 ' CE1' HG13 ' A' ' 94' ' ' ILE . 6.9 m-85 -73.6 -31.82 63.78 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 119.029 -1.068 . . . . 0.0 109.553 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -63.91 -38.24 90.37 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.052 -1.03 . . . . 0.0 109.337 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -41.17 97.7 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.515 179.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.99 -46.02 90.84 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.287 -0.883 . . . . 0.0 109.302 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -56.35 -33.73 65.95 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.765 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 24.7 mtp-105 -105.85 30.24 5.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.174 -0.953 . . . . 0.0 110.627 179.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -107.69 167.83 9.68 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.906 -1.121 . . . . 0.0 109.97 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.0 mtp85 -63.29 155.18 29.3 Favored 'General case' 0 N--CA 1.508 2.441 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.002 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.38 -34.74 20.11 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.265 -0.897 . . . . 0.0 110.632 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.05 -36.91 51.89 Favored 'General case' 0 N--CA 1.513 2.686 0 O-C-N 120.964 -1.085 . . . . 0.0 110.708 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.3 m -113.88 119.98 39.13 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.125 -0.984 . . . . 0.0 110.174 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.9 tptm -121.34 145.02 48.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.23 -0.919 . . . . 0.0 110.266 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 158.22 30.74 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.233 -0.917 . . . . 0.0 110.256 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.3 mt 54.41 98.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.126 -0.984 . . . . 0.0 110.661 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -114.2 138.06 50.96 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.183 -0.948 . . . . 0.0 110.069 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.33 -166.01 0.07 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.061 -1.024 . . . . 0.0 110.596 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.447 ' CD2' ' OG1' ' A' ' 91' ' ' THR . 4.5 tp -115.63 39.54 2.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.176 -0.953 . . . . 0.0 110.374 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.4 HG21 ' CZ2' ' A' ' 79' ' ' TRP . 2.9 p -149.28 38.04 0.78 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.577 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -137.02 37.08 2.57 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.23 -0.919 . . . . 0.0 110.247 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -122.09 152.25 40.04 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.113 -0.992 . . . . 0.0 109.906 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.35 106.76 0.8 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.312 -0.868 . . . . 0.0 111.359 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 65.81 59.31 7.73 Favored Glycine 0 N--CA 1.492 2.423 0 O-C-N 121.247 -0.908 . . . . 0.0 111.161 178.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.474 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 34.9 p-90 -88.94 -38.19 14.67 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.967 -1.314 . . . . 0.0 109.952 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.474 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 8.5 tm-20 -69.2 -40.74 77.87 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.164 -0.96 . . . . 0.0 109.082 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.24 -28.02 50.36 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.199 -0.938 . . . . 0.0 111.144 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.43 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 95.6 mt -69.81 -175.06 0.83 Allowed 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.624 -1.297 . . . . 0.0 109.762 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -62.76 155.25 27.18 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.168 -0.957 . . . . 0.0 110.06 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -87.88 -41.07 13.46 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.241 -0.912 . . . . 0.0 110.192 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -65.66 -43.99 87.7 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.28 -0.887 . . . . 0.0 109.56 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 47.8 mt-10 -64.63 -39.47 93.76 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.332 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.7 tptt -58.52 -39.16 79.34 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.257 -0.902 . . . . 0.0 109.76 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.7 -37.93 74.33 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.242 -0.911 . . . . 0.0 109.969 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -59.24 -39.22 82.08 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.232 -0.917 . . . . 0.0 110.062 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 70.2 mt -64.53 -41.05 91.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 O-C-N 121.169 -0.957 . . . . 0.0 109.058 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.447 ' OG1' ' CD2' ' A' ' 73' ' ' LEU . 2.0 m -57.08 -38.45 73.34 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.179 -0.95 . . . . 0.0 109.966 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.11 -40.35 80.99 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.223 -0.923 . . . . 0.0 109.8 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.498 ' NE2' HG23 ' A' ' 53' ' ' ILE . 2.1 m-70 -60.39 -50.59 72.98 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.163 -0.961 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.431 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.0 mt -62.5 -39.44 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 109.471 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.67 -41.31 96.18 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.218 -0.926 . . . . 0.0 109.272 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.53 -40.99 69.71 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.028 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.9 tp -69.64 -33.85 73.2 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.282 -0.886 . . . . 0.0 110.073 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 18.2 t -96.44 -65.5 0.96 Allowed 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.1 t 52.39 94.7 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.079 -1.013 . . . . 0.0 110.792 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.27 85.63 2.07 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.226 -0.921 . . . . 0.0 110.27 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -138.95 169.71 17.3 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.158 -0.964 . . . . 0.0 110.161 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.42 87.16 2.11 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.213 -0.93 . . . . 0.0 110.173 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -131.07 -91.79 0.57 Allowed Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -119.19 83.14 24.11 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.178 -1.189 . . . . 0.0 110.223 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.7 -172.48 0.95 Allowed 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.417 1.219 . . . . 0.0 110.409 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -117.57 141.97 47.74 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.175 -0.953 . . . . 0.0 110.247 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -124.42 79.86 1.79 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.186 -0.946 . . . . 0.0 110.166 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -139.48 98.06 3.41 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.196 -0.94 . . . . 0.0 110.216 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.32 111.67 17.64 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.148 -0.97 . . . . 0.0 110.268 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 10.5 p -131.86 124.04 52.69 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.179 -0.951 . . . . 0.0 110.527 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.0 t -138.31 132.28 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.133 -0.979 . . . . 0.0 110.014 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -118.47 125.69 50.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.189 -0.944 . . . . 0.0 110.23 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.07 111.79 19.37 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.228 -0.92 . . . . 0.0 110.265 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -117.42 98.05 6.21 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.142 -0.974 . . . . 0.0 110.18 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.4 tp -120.07 135.85 54.79 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.229 -0.92 . . . . 0.0 110.297 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.448 ' O ' ' OG1' ' A' ' 117' ' ' THR . 11.2 m -127.1 117.67 22.86 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.17 -0.956 . . . . 0.0 110.229 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . 0.448 ' OG1' ' O ' ' A' ' 116' ' ' THR . 78.9 p . . . . . 0 N--CA 1.504 2.266 0 CA-C-O 118.106 -0.95 . . . . 0.0 111.48 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.9 mtm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.686 0.279 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.78 80.49 1.85 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.193 -0.942 . . . . 0.0 110.118 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -138.12 68.71 1.39 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.209 -0.932 . . . . 0.0 110.221 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 57.68 107.92 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.081 -1.012 . . . . 0.0 110.814 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -128.13 137.48 52.13 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.134 -0.978 . . . . 0.0 110.271 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.422 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 1.5 m-85 -115.98 137.65 51.92 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.136 -0.978 . . . . 0.0 110.162 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -122.25 164.93 17.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.25 -0.906 . . . . 0.0 109.308 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 32.7 m -134.97 134.3 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.926 -1.109 . . . . 0.0 110.815 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -139.93 147.63 40.81 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.211 -0.93 . . . . 0.0 109.876 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.431 ' OH ' HD13 ' A' ' 90' ' ' ILE . 1.7 m-85 -101.44 148.03 25.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.239 -0.913 . . . . 0.0 109.985 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -108.09 144.87 34.87 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.289 -0.882 . . . . 0.0 110.557 -179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -115.17 -56.4 2.37 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.224 -0.923 . . . . 0.0 110.122 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 mtt85 -141.39 72.95 1.4 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.48 -176.2 15.61 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 34.9 m -140.22 116.16 10.35 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.154 -1.204 . . . . 0.0 110.235 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.19 133.3 24.36 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.163 -0.96 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -76.62 123.33 6.66 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.2 t -61.4 127.78 33.14 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.266 -1.138 . . . . 0.0 109.483 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -61.51 147.94 43.69 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.188 -0.945 . . . . 0.0 109.201 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 54.21 44.24 29.4 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.872 -1.142 . . . . 0.0 109.468 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.4 t -165.87 149.65 7.92 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.374 -0.829 . . . . 0.0 110.692 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 tttt -101.09 51.27 0.85 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 0.0 108.678 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.16 -174.99 4.44 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.453 -0.78 . . . . 0.0 110.339 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -133.67 161.05 35.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.184 -0.947 . . . . 0.0 109.759 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 51.7 mt -111.28 110.86 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.408 -0.808 . . . . 0.0 109.775 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.5 t -141.04 103.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.134 -0.978 . . . . 0.0 111.455 -179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.8 tttp 59.91 142.4 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.204 -0.935 . . . . 0.0 112.171 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.94 12.64 65.31 Favored Glycine 0 N--CA 1.497 2.754 0 O-C-N 121.088 -1.008 . . . . 0.0 111.841 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 84.0 t -128.77 136.65 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 CA-C-N 119.786 1.793 . . . . 0.0 110.486 -179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 3.0 t -94.57 131.55 40.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.284 -0.885 . . . . 0.0 108.788 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 8.7 mtp180 -106.52 129.31 54.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.149 -0.969 . . . . 0.0 110.719 -179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.2 mt -104.31 127.11 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.91 126.97 9.07 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.422 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.7 ttpm? -103.44 107.83 18.83 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.365 -1.079 . . . . 0.0 109.331 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -102.03 107.86 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.161 -0.962 . . . . 0.0 110.605 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 34.4 m -123.57 146.22 49.4 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.282 -0.886 . . . . 0.0 109.778 179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -76.04 135.62 17.42 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.224 1.118 . . . . 0.0 110.353 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -103.36 143.17 26.08 Favored Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 121.182 -0.949 . . . . 0.0 109.886 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.54 71.36 3.19 Favored 'Trans proline' 0 N--CA 1.486 1.033 0 O-C-N 123.255 1.134 . . . . 0.0 110.213 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -148.0 -58.83 0.25 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.16 -0.962 . . . . 0.0 110.495 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -113.13 155.75 24.41 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.127 -0.983 . . . . 0.0 110.239 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -97.86 -36.77 10.07 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.221 -0.924 . . . . 0.0 110.772 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.0 m -87.37 -40.18 14.65 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.932 -1.105 . . . . 0.0 110.04 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -128.45 82.98 0.33 Allowed Glycine 0 N--CA 1.494 2.517 0 N-CA-C 109.426 -1.47 . . . . 0.0 109.426 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -136.91 59.56 0.63 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -134.32 142.21 47.18 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.239 -1.153 . . . . 0.0 110.039 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 34.8 mtp -117.71 137.09 52.92 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.117 -0.989 . . . . 0.0 110.618 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -131.56 129.11 40.56 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.218 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -132.84 155.01 49.76 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.206 -0.934 . . . . 0.0 109.888 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -98.49 163.37 12.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.115 -0.99 . . . . 0.0 110.006 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -145.71 172.37 13.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.227 -0.92 . . . . 0.0 110.596 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 -172.27 2.68 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.504 HG23 ' NE2' ' A' ' 93' ' ' HIS . 45.2 mm -86.72 -40.07 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.088 0 O-C-N 121.021 -1.049 . . . . 0.0 108.999 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -89.32 -24.47 22.0 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 120.864 -1.148 . . . . 0.0 111.012 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.4 m -75.17 -44.87 44.3 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.734 -1.229 . . . . 0.0 110.01 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -37.66 69.3 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.919 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.427 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 8.0 m-85 -74.08 -31.8 62.98 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.417 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.08 -37.75 88.44 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.002 -1.061 . . . . 0.0 109.531 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.0 tttp -58.71 -39.56 81.14 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.117 -0.989 . . . . 0.0 109.849 179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.3 mp -59.35 -43.33 92.81 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.264 -0.898 . . . . 0.0 109.299 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -36.16 74.95 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.282 -0.886 . . . . 0.0 109.513 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.3 mmt-85 -105.86 31.28 5.15 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.241 -0.912 . . . . 0.0 110.561 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -109.11 168.6 9.26 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.907 -1.121 . . . . 0.0 110.109 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.4 mtm-85 -80.62 157.08 26.09 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.28 -0.888 . . . . 0.0 110.243 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -78.46 -33.7 48.21 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.163 -0.961 . . . . 0.0 110.542 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.0 m -50.9 -35.93 35.53 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 120.943 -1.098 . . . . 0.0 110.869 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.51 147.4 34.21 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.102 -0.999 . . . . 0.0 110.011 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -133.97 145.51 49.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.196 -0.94 . . . . 0.0 110.393 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 22.9 mtmm -131.04 148.96 52.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.168 -0.958 . . . . 0.0 110.218 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.4 mt 53.78 97.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.091 -1.006 . . . . 0.0 110.809 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -113.32 133.76 54.96 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.197 -0.939 . . . . 0.0 109.692 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 53.08 -170.54 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.958 -1.089 . . . . 0.0 110.333 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -108.39 -58.58 1.98 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.081 -1.012 . . . . 0.0 110.051 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -33.74 70.16 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.166 -0.959 . . . . 0.0 110.544 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -49.07 -33.78 12.26 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 120.989 -1.07 . . . . 0.0 111.462 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 54.7 mt -82.65 152.38 25.88 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.008 -1.058 . . . . 0.0 109.994 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -92.75 136.58 33.11 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.266 -0.896 . . . . 0.0 110.572 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 136.75 -47.49 0.96 Allowed Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.444 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 54.7 p-90 -50.48 -30.24 12.3 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.15 -1.206 . . . . 0.0 111.449 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.444 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 6.4 tm-20 -52.52 -28.85 22.29 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.883 -1.136 . . . . 0.0 111.28 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -113.06 29.31 8.08 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.95 -1.094 . . . . 0.0 111.788 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 33.3 mt -113.28 -165.85 1.03 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.854 -1.154 . . . . 0.0 109.799 179.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -100.78 162.21 13.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.049 -1.032 . . . . 0.0 110.068 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -79.12 -39.77 32.77 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.202 -0.936 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -69.19 -41.42 77.16 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.159 -0.963 . . . . 0.0 109.501 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -39.15 73.05 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.918 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.1 ttpt -61.11 -39.23 89.2 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.171 -0.955 . . . . 0.0 109.531 178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -56.93 -34.9 68.43 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.141 -0.974 . . . . 0.0 110.212 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -58.12 -39.41 78.63 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.16 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.431 HD13 ' OH ' ' A' ' 10' ' ' TYR . 10.9 mt -66.29 -40.88 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.401 0 O-C-N 121.176 -0.953 . . . . 0.0 109.219 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.1 m -58.9 -37.89 77.65 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.256 -0.903 . . . . 0.0 110.0 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -58.9 -40.47 84.58 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.154 -0.966 . . . . 0.0 109.822 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.504 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.7 m-70 -60.38 -49.66 76.7 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.155 -0.966 . . . . 0.0 109.75 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.427 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.9 mt -63.79 -39.4 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.215 -0.928 . . . . 0.0 109.565 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.18 -40.7 98.27 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.142 -0.974 . . . . 0.0 109.341 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -71.86 -38.3 70.08 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.261 -0.9 . . . . 0.0 109.226 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.0 tp -72.95 -37.34 67.16 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.271 -0.893 . . . . 0.0 109.951 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 m -65.28 -51.47 60.57 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.098 -1.001 . . . . 0.0 109.991 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.07 118.56 30.92 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.173 -0.955 . . . . 0.0 110.305 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.5 tttt -143.44 -59.7 0.41 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.212 -0.93 . . . . 0.0 110.186 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 52.69 61.44 3.19 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.011 -1.056 . . . . 0.0 110.684 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.27 46.8 2.02 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.099 -1.001 . . . . 0.0 110.217 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -131.04 -63.5 0.09 OUTLIER Glycine 0 N--CA 1.493 2.468 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 59.5 m 52.57 73.49 0.94 Allowed Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 121.025 -1.28 . . . . 0.0 110.809 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.13 -173.78 1.37 Allowed 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.301 1.158 . . . . 0.0 110.391 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -131.78 -60.18 0.93 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.176 -0.952 . . . . 0.0 110.313 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -136.44 147.54 47.27 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.188 -0.945 . . . . 0.0 110.31 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -127.62 89.82 3.01 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.279 -0.888 . . . . 0.0 110.164 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -126.08 167.59 15.15 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.247 -0.908 . . . . 0.0 110.207 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 57.4 t -111.65 121.87 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.209 -0.932 . . . . 0.0 110.03 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.2 t -129.68 143.83 39.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.161 -0.962 . . . . 0.0 109.954 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -113.05 116.93 30.68 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.196 -0.94 . . . . 0.0 110.12 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.1 142.25 47.62 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.108 -0.995 . . . . 0.0 110.268 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -111.4 117.69 33.77 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.208 -0.933 . . . . 0.0 110.222 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.0 tp -117.13 141.76 47.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.225 -0.922 . . . . 0.0 110.251 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 m -131.99 100.28 5.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.161 -0.962 . . . . 0.0 110.291 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.131 0 O-C-N 121.06 -1.025 . . . . 0.0 110.778 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ttt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 120.679 0.276 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -116.88 95.58 5.08 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.2 -0.938 . . . . 0.0 110.242 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -117.55 131.33 56.71 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.225 -0.922 . . . . 0.0 110.202 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -141.33 135.44 30.53 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.195 -0.941 . . . . 0.0 110.222 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -124.51 131.61 53.49 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.266 -0.896 . . . . 0.0 110.185 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.5 m-85 -125.15 136.76 53.93 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.153 -0.967 . . . . 0.0 110.275 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -121.89 164.12 18.09 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.243 -0.91 . . . . 0.0 109.062 179.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 25.4 m -130.95 134.98 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.945 -1.097 . . . . 0.0 110.465 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -139.67 156.69 46.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.151 -0.968 . . . . 0.0 110.2 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.424 ' CZ ' ' HB3' ' A' ' 86' ' ' GLU . 0.5 OUTLIER -105.97 156.15 18.66 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.366 -0.834 . . . . 0.0 110.069 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.05 102.67 12.71 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.261 -0.899 . . . . 0.0 110.503 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -115.13 -56.21 2.39 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.303 -0.873 . . . . 0.0 109.94 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -114.91 83.19 1.86 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.202 -0.936 . . . . 0.0 110.029 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 142.08 170.47 12.57 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -143.91 140.84 29.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.175 -1.191 . . . . 0.0 110.531 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.03 147.38 51.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.249 -0.907 . . . . 0.0 110.471 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.43 122.05 5.83 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 7.1 t -64.49 124.54 22.1 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.177 -1.19 . . . . 0.0 109.447 179.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 148.54 40.32 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.999 -1.063 . . . . 0.0 108.939 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 mttm 52.85 64.1 1.99 Allowed 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.982 -1.074 . . . . 0.0 108.984 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.5 t -172.98 -44.45 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.264 -0.897 . . . . 0.0 112.54 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt 70.08 44.15 0.81 Allowed 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.935 -1.103 . . . . 0.0 108.341 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -141.05 -170.05 2.96 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.539 -0.726 . . . . 0.0 109.364 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -127.6 156.02 42.93 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.883 -1.135 . . . . 0.0 110.92 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.425 HG12 ' CD2' ' A' ' 52' ' ' HIS . 15.8 mt -120.09 104.2 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -0.757 . . . . 0.0 109.615 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 10.1 p -163.84 147.59 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.084 -1.01 . . . . 0.0 111.578 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt 53.94 102.82 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.381 -0.824 . . . . 0.0 111.664 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.22 11.28 85.05 Favored Glycine 0 N--CA 1.494 2.549 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.012 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.402 ' CG1' ' CG2' ' A' ' 25' ' ' ILE . 93.1 t -121.78 135.2 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 CA-C-N 119.87 1.835 . . . . 0.0 110.634 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.7 t -105.75 141.19 37.61 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.26 -0.9 . . . . 0.0 108.829 178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 3.2 ptp180 -122.21 144.66 48.83 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.154 -0.966 . . . . 0.0 111.408 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 17.6 mt -107.16 137.51 37.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.339 -0.851 . . . . 0.0 109.412 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.446 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.32 128.2 9.39 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.164 -1.575 . . . . 0.0 109.164 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.419 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 30.0 tttt -112.23 117.53 32.79 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.192 -1.181 . . . . 0.0 109.973 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.8 t -100.55 109.04 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.072 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.3 t -120.79 124.38 27.54 Favored Pre-proline 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 109.773 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.85 142.58 35.47 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 O-C-N 123.146 1.077 . . . . 0.0 110.452 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -103.47 154.23 37.98 Favored Pre-proline 0 N--CA 1.499 2.003 0 O-C-N 121.16 -0.963 . . . . 0.0 110.216 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.8 70.11 4.38 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.434 1.228 . . . . 0.0 110.463 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -152.9 -58.37 0.14 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.09 -1.006 . . . . 0.0 110.418 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.5 156.84 21.93 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.201 -0.937 . . . . 0.0 110.079 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -101.31 -48.02 4.51 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.141 -0.975 . . . . 0.0 110.31 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 61.3 p -88.86 -39.88 13.52 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.15 -0.969 . . . . 0.0 110.268 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -111.57 65.89 0.25 Allowed Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.65 72.63 0.36 Allowed Glycine 0 N--CA 1.495 2.609 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -146.09 135.11 22.63 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.16 -1.2 . . . . 0.0 110.351 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.5 mtp -117.62 141.52 48.28 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.194 -0.941 . . . . 0.0 110.366 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -130.42 127.71 39.86 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.132 -0.98 . . . . 0.0 110.25 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.92 153.57 42.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.122 -0.986 . . . . 0.0 110.088 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 56.6 m95 -105.98 129.6 54.07 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.194 -0.941 . . . . 0.0 109.949 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -112.41 177.11 4.75 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.21 -0.931 . . . . 0.0 111.162 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.425 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -94.69 -170.68 2.29 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.519 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.454 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 46.3 mm -88.3 -43.6 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.044 -1.035 . . . . 0.0 108.982 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -21.95 27.27 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.993 -1.067 . . . . 0.0 111.399 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 63.0 m -75.38 -43.68 48.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.683 -1.261 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.2 tpt -73.59 -39.33 64.7 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.733 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.496 ' CD2' ' CD2' ' A' ' 93' ' ' HIS . 10.1 m-85 -73.32 -30.21 63.21 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.967 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.42 -36.83 82.03 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.927 -1.108 . . . . 0.0 109.403 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -58.5 -38.64 78.09 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.991 -1.068 . . . . 0.0 109.888 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.2 -41.33 86.0 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.746 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -67.01 -33.58 75.87 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.3 -0.875 . . . . 0.0 110.647 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 18.2 ttt85 -86.5 -35.88 19.34 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.12 -0.988 . . . . 0.0 110.42 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -113.3 127.98 56.32 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.045 -1.034 . . . . 0.0 110.061 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.6 mtt85 -112.57 101.24 9.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.162 -0.961 . . . . 0.0 110.249 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -90.38 4.06 51.98 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.267 -0.895 . . . . 0.0 111.881 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.6 m 56.02 36.34 27.19 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.467 -1.396 . . . . 0.0 110.349 -179.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 58.8 m -117.56 161.72 19.17 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.199 -0.938 . . . . 0.0 109.92 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 tppt? -97.37 95.02 7.4 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.213 -0.929 . . . . 0.0 109.976 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -123.54 135.04 53.8 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.239 -0.913 . . . . 0.0 110.143 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.411 HD11 HG22 ' A' ' 70' ' ' ILE . 77.5 mt 52.84 94.71 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.048 -1.033 . . . . 0.0 110.589 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -115.22 135.4 54.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.966 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 53.46 -165.25 0.08 Allowed 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.1 -1.0 . . . . 0.0 110.542 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.3 tt -103.68 -48.12 4.04 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.171 -0.955 . . . . 0.0 110.354 179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.31 69.62 4.54 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.125 -0.985 . . . . 0.0 109.817 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -143.49 -58.6 0.41 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.267 -0.896 . . . . 0.0 110.07 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.3 mt -62.52 151.59 37.12 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.163 -0.961 . . . . 0.0 109.564 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -79.94 128.84 33.95 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.184 -0.948 . . . . 0.0 110.262 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 143.71 -47.62 0.78 Allowed Glycine 0 N--CA 1.494 2.505 0 C-N-CA 119.753 -1.213 . . . . 0.0 110.588 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.447 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 45.9 p-90 -51.7 -30.54 22.51 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.917 -1.343 . . . . 0.0 111.216 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 5.8 tp10 -53.76 -27.91 31.45 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.963 -1.086 . . . . 0.0 111.332 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -111.74 26.95 10.11 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.821 -1.174 . . . . 0.0 112.064 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.409 HD12 ' CD2' ' A' ' 10' ' ' TYR . 29.9 mt -108.81 -164.27 0.93 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.812 -1.18 . . . . 0.0 109.555 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -94.98 161.89 13.96 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.957 -1.09 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -76.36 -47.9 21.79 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.238 -0.914 . . . . 0.0 109.999 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.3 -41.65 93.88 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.236 -0.915 . . . . 0.0 109.594 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.424 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 15.3 mt-10 -59.46 -39.98 85.4 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.291 -0.881 . . . . 0.0 109.628 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.6 ttpp -56.39 -39.23 72.63 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.207 -0.933 . . . . 0.0 109.97 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -57.88 -37.92 74.82 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.263 -0.898 . . . . 0.0 109.961 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -70.07 -33.72 72.28 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.122 -0.986 . . . . 0.0 110.031 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.9 mt -70.37 -38.64 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.11 -0.994 . . . . 0.0 110.003 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.402 HG21 ' N ' ' A' ' 92' ' ' GLN . 9.5 t -69.04 -32.42 71.9 Favored 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 118.913 -1.115 . . . . 0.0 110.276 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.402 ' N ' HG21 ' A' ' 91' ' ' THR . 0.4 OUTLIER -71.58 -39.89 70.29 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.992 -1.067 . . . . 0.0 108.781 178.443 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.496 ' CD2' ' CD2' ' A' ' 57' ' ' PHE . 70.0 t60 -56.27 -43.79 79.12 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.268 -0.895 . . . . 0.0 109.721 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.439 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 58.0 mt -67.94 -39.68 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.905 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.43 85.12 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.16 -0.963 . . . . 0.0 109.681 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.35 -42.29 95.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.16 -0.963 . . . . 0.0 109.377 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.6 tp -66.07 -35.86 81.65 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.297 -0.877 . . . . 0.0 109.859 179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 73.6 m -105.09 58.6 0.68 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.156 -0.965 . . . . 0.0 109.971 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t -129.91 62.41 1.55 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.091 -1.006 . . . . 0.0 110.283 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -143.32 40.06 1.45 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.098 -1.001 . . . . 0.0 110.232 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.58 41.9 1.59 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.2 -0.938 . . . . 0.0 110.215 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.55 120.14 11.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.179 -0.95 . . . . 0.0 110.283 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 63.48 173.66 2.62 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.1 m -136.21 85.31 27.7 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.197 -1.178 . . . . 0.0 110.201 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.43 171.19 17.55 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 O-C-N 123.351 1.185 . . . . 0.0 110.433 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.5 mtmt -117.55 -57.27 2.14 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.227 -0.921 . . . . 0.0 110.222 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.5 mmtm -117.42 134.53 54.73 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.246 -0.909 . . . . 0.0 110.273 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.34 60.47 1.7 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.173 -0.954 . . . . 0.0 110.247 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.68 138.36 51.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.139 -0.976 . . . . 0.0 110.204 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.64 148.49 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.235 -0.916 . . . . 0.0 110.206 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.3 t -113.96 130.3 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.235 -0.915 . . . . 0.0 110.021 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -117.45 135.09 54.14 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.155 -0.966 . . . . 0.0 110.272 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.34 129.26 55.76 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.16 -0.962 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -117.31 136.74 52.91 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.231 -0.918 . . . . 0.0 110.218 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 tp -117.96 144.88 45.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.214 -0.928 . . . . 0.0 110.248 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 35.3 p -117.89 109.48 16.58 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.177 -0.952 . . . . 0.0 110.195 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.7 m . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.192 179.975 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 ttm . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.19 40.25 2.88 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.163 -0.961 . . . . 0.0 110.238 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -144.65 136.44 25.79 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.156 -0.965 . . . . 0.0 110.341 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -144.96 151.69 39.03 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.21 -0.932 . . . . 0.0 110.322 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -139.69 131.85 28.09 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.235 -0.916 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.42 ' CE2' ' HG3' ' A' ' 34' ' ' LYS . 1.1 m-85 -125.4 139.95 53.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.166 -0.959 . . . . 0.0 110.25 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.5 m -127.39 163.19 24.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.921 . . . . 0.0 108.871 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.403 ' CG2' ' N ' ' A' ' 79' ' ' TRP . 29.2 m -133.76 133.29 56.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.95 -1.094 . . . . 0.0 110.753 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -139.3 155.28 47.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.307 -0.871 . . . . 0.0 109.989 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.413 ' CE2' HD22 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -102.11 143.15 32.29 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.31 -0.869 . . . . 0.0 109.884 179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.31 138.38 56.47 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.156 -0.965 . . . . 0.0 110.146 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mttt -130.05 -59.8 1.04 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 110.334 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.01 93.31 2.38 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.199 -0.938 . . . . 0.0 110.422 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.9 142.97 4.23 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 29.8 p -114.69 147.01 40.24 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.259 -1.142 . . . . 0.0 109.921 179.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.62 147.79 38.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.089 -1.007 . . . . 0.0 111.003 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.94 124.88 18.23 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.1 t -61.36 131.05 49.03 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.221 -1.164 . . . . 0.0 109.344 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm -62.22 148.17 45.57 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.156 -0.965 . . . . 0.0 109.269 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttt 52.45 47.42 24.75 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.972 -1.08 . . . . 0.0 109.673 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.3 t -164.8 153.03 12.06 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.31 -0.869 . . . . 0.0 110.895 -178.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 tttm -103.84 46.96 0.89 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -142.05 -174.37 4.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.404 -0.81 . . . . 0.0 110.197 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -133.2 156.27 47.82 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.222 -0.924 . . . . 0.0 109.727 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.435 HD11 HG22 ' A' ' 25' ' ' ILE . 62.2 mt -96.35 113.04 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.81 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 67.9 t -108.51 162.78 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -41.44 133.15 2.59 Favored 'General case' 0 N--CA 1.519 3.02 0 O-C-N 121.689 -0.632 . . . . 0.0 111.527 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.8 4.31 45.61 Favored Glycine 0 N--CA 1.493 2.453 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.084 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 89.3 t -115.11 134.79 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-N 119.582 1.691 . . . . 0.0 109.546 179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.9 t -85.39 134.41 34.08 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.169 -0.957 . . . . 0.0 108.933 178.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 46.1 mtm105 -115.43 135.48 54.07 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.177 -0.952 . . . . 0.0 111.275 -178.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 12.9 mt -104.7 129.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.1 131.71 10.7 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.42 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 22.7 tttt -110.78 113.45 26.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.327 -1.102 . . . . 0.0 109.566 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.73 107.62 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.148 -0.97 . . . . 0.0 110.198 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 7.2 p -124.08 127.17 25.45 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.282 -0.886 . . . . 0.0 110.193 179.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.63 139.05 27.62 Favored 'Trans proline' 0 C--N 1.319 -0.983 0 O-C-N 123.088 1.046 . . . . 0.0 110.514 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -103.44 118.74 56.94 Favored Pre-proline 0 N--CA 1.5 2.061 0 O-C-N 121.285 -0.885 . . . . 0.0 109.95 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -73.1 80.13 1.91 Allowed 'Trans proline' 0 N--CA 1.486 1.036 0 O-C-N 123.078 1.041 . . . . 0.0 110.588 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -149.95 -58.69 0.19 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.238 -0.914 . . . . 0.0 110.433 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.92 156.67 20.85 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.189 -0.944 . . . . 0.0 110.18 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -97.8 -39.84 8.83 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.216 -0.927 . . . . 0.0 110.634 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.7 m -55.71 -38.68 70.04 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 120.987 -1.071 . . . . 0.0 110.395 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.81 -175.92 25.02 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -141.37 -95.71 0.26 Allowed Glycine 0 N--CA 1.493 2.499 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -130.82 146.59 52.31 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.193 -1.18 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.2 ttm -115.66 149.08 38.93 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.191 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -129.23 148.75 51.2 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.552 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.47 155.28 48.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.57 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 71.0 m95 -98.13 156.87 16.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.122 -0.986 . . . . 0.0 110.157 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -136.15 172.99 12.2 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.317 -0.864 . . . . 0.0 110.546 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.72 -170.42 2.58 Favored 'General case' 0 N--CA 1.504 2.232 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.483 HG23 ' NE2' ' A' ' 93' ' ' HIS . 42.1 mm -83.89 -60.02 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.161 179.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.42 ' HE2' ' CE1' ' A' ' 93' ' ' HIS . 23.7 mmtt -73.82 -27.42 61.11 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.927 -1.108 . . . . 0.0 111.262 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 84.5 m -65.87 -51.47 58.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 120.741 -1.224 . . . . 0.0 110.253 -179.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.406 ' CE ' ' CD1' ' A' ' 70' ' ' ILE . 0.6 OUTLIER -70.05 -39.55 75.65 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.814 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.434 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 8.6 m-85 -71.85 -28.56 63.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.2 -1.0 . . . . 0.0 109.944 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -67.38 -37.01 82.48 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.789 -1.194 . . . . 0.0 109.43 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -58.58 -40.49 83.29 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.023 -1.048 . . . . 0.0 109.755 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.22 -42.17 98.14 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.227 -0.921 . . . . 0.0 109.129 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -56.71 -33.83 66.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.152 -0.968 . . . . 0.0 109.67 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.8 mtt-85 -103.35 29.84 5.34 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.215 -0.928 . . . . 0.0 110.497 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.0 168.61 9.3 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.882 -1.136 . . . . 0.0 109.976 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -63.1 152.14 38.03 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.164 -0.96 . . . . 0.0 110.096 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.96 -33.76 19.54 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.188 -0.945 . . . . 0.0 110.742 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 p -49.73 -34.72 19.73 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 120.931 -1.106 . . . . 0.0 111.187 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -109.6 139.92 44.03 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.037 -1.039 . . . . 0.0 110.164 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -114.94 144.41 43.62 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.225 -0.922 . . . . 0.0 110.136 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -123.24 136.71 54.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.204 -0.935 . . . . 0.0 110.461 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.406 ' CD1' ' CE ' ' A' ' 56' ' ' MET . 83.4 mt 54.54 101.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.949 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -110.23 141.17 43.55 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.158 -0.964 . . . . 0.0 109.789 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.6 t0 53.41 -169.9 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.035 -1.041 . . . . 0.0 110.416 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.428 HD23 ' OG1' ' A' ' 91' ' ' THR . 18.7 tp -118.52 38.58 3.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.105 -0.997 . . . . 0.0 110.648 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 35.98 0.82 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.132 -0.98 . . . . 0.0 110.55 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -131.43 29.45 4.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.201 -0.937 . . . . 0.0 110.559 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 96.4 mt -137.46 153.57 50.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.045 -1.034 . . . . 0.0 109.401 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.8 102.24 11.47 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.07 -1.018 . . . . 0.0 110.393 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.93 -39.11 0.6 Allowed Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.674 -1.25 . . . . 0.0 111.105 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.403 ' N ' ' CG2' ' A' ' 8' ' ' VAL . 46.6 p-90 -57.26 -32.17 66.32 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.832 -1.393 . . . . 0.0 110.913 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -53.26 -34.27 56.5 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.832 -1.167 . . . . 0.0 110.612 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.86 -36.06 31.89 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.999 -1.063 . . . . 0.0 110.295 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.413 HD22 ' CE2' ' A' ' 10' ' ' TYR . 0.2 OUTLIER -51.02 176.91 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.965 -1.084 . . . . 0.0 110.66 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -104.02 160.4 14.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.078 -1.014 . . . . 0.0 110.406 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -60.44 -46.01 91.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.238 -0.914 . . . . 0.0 110.086 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -61.56 -48.04 82.79 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.553 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -64.66 -40.59 95.69 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.429 -0.909 . . . . 0.0 109.197 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.409 ' O ' ' OG1' ' A' ' 91' ' ' THR . 12.5 tttm -62.3 -38.9 91.17 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.347 -0.846 . . . . 0.0 109.911 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.07 -41.12 97.84 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.196 -0.94 . . . . 0.0 109.893 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -66.89 -38.04 85.53 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.244 -0.91 . . . . 0.0 110.081 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 90' ' ' ILE . 45.7 mm -67.14 -38.5 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.124 -0.985 . . . . 0.0 109.338 179.273 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.428 ' OG1' HD23 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -59.24 -39.03 81.47 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.135 -0.978 . . . . 0.0 109.811 179.472 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -56.02 -36.76 68.33 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.063 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.483 ' NE2' HG23 ' A' ' 53' ' ' ILE . 0.2 OUTLIER -58.82 -51.61 69.26 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.677 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.434 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.2 mt -60.79 -37.59 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.225 -0.922 . . . . 0.0 109.704 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.09 86.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.168 -0.957 . . . . 0.0 109.62 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.37 -43.35 77.56 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.232 -0.917 . . . . 0.0 108.791 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.73 -35.06 79.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.315 -0.865 . . . . 0.0 109.77 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.3 m -100.62 66.59 1.23 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.981 -1.074 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.3 t -138.34 165.89 25.61 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.126 -0.984 . . . . 0.0 110.177 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -138.94 -175.74 4.25 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.279 -0.888 . . . . 0.0 110.15 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.05 112.12 18.31 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.167 -0.958 . . . . 0.0 110.242 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.92 48.07 1.81 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.297 -0.877 . . . . 0.0 110.226 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -103.3 -146.41 16.82 Favored Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.496 -1.441 . . . . 0.0 109.496 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 36.1 m -130.8 95.75 25.05 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.233 -1.157 . . . . 0.0 110.185 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.8 161.4 43.89 Favored 'Trans proline' 0 C--N 1.317 -1.102 0 O-C-N 123.378 1.199 . . . . 0.0 110.41 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.1 tttp 52.56 94.65 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.03 -1.044 . . . . 0.0 110.758 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -120.9 147.37 45.51 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.212 -0.93 . . . . 0.0 110.284 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.4 mtpp -124.13 145.22 49.42 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.168 -0.958 . . . . 0.0 110.201 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -120.63 166.99 12.9 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.186 -0.946 . . . . 0.0 110.198 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.9 t -116.63 101.44 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.225 -0.922 . . . . 0.0 109.986 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.9 t -122.53 109.56 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.321 -0.862 . . . . 0.0 110.0 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -118.53 128.59 54.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.181 -0.949 . . . . 0.0 110.137 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -133.87 127.2 32.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.185 -0.947 . . . . 0.0 110.294 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 pttt -126.05 150.72 47.94 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.178 -0.951 . . . . 0.0 110.294 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.9 tp -126.9 150.63 49.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.189 -0.944 . . . . 0.0 110.142 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.72 138.98 52.28 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.253 -0.905 . . . . 0.0 110.191 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 5.8 m . . . . . 0 N--CA 1.502 2.172 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.733 179.953 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.4 mtp . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.95 161.41 20.93 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.221 -0.924 . . . . 0.0 110.316 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -124.38 127.43 47.55 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.228 -0.92 . . . . 0.0 110.089 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -133.72 159.48 40.44 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.153 -0.967 . . . . 0.0 110.337 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.2 137.86 31.08 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.217 -0.927 . . . . 0.0 110.191 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.425 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.7 m-85 -117.25 142.13 47.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.9 m -130.51 165.0 23.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.262 -0.899 . . . . 0.0 109.314 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.8 m -130.64 139.83 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.066 -1.022 . . . . 0.0 110.641 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.02 107.66 4.12 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.239 -0.913 . . . . 0.0 110.35 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.423 ' CD2' HD12 ' A' ' 82' ' ' LEU . 10.5 m-85 -58.9 153.03 18.13 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.162 -0.961 . . . . 0.0 110.054 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.75 136.55 48.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.309 -0.869 . . . . 0.0 110.311 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -120.16 -57.34 1.94 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.253 -0.904 . . . . 0.0 110.306 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -128.24 122.99 33.06 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.097 -1.002 . . . . 0.0 110.161 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.98 170.88 11.96 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.422 ' OG1' HG13 ' A' ' 26' ' ' VAL . 57.4 m -140.98 135.44 31.17 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.18 -1.188 . . . . 0.0 110.126 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.44 137.17 26.8 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.16 -0.963 . . . . 0.0 110.734 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.6 123.21 15.73 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.6 t -62.37 130.9 47.39 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.246 -1.15 . . . . 0.0 109.46 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -62.41 147.33 48.89 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.117 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? 52.5 48.21 23.06 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.02 -1.05 . . . . 0.0 109.579 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -164.93 153.3 12.04 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.401 -0.812 . . . . 0.0 110.852 -178.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -104.05 46.27 0.92 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -143.28 -174.63 4.26 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.498 -0.751 . . . . 0.0 110.077 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -136.16 155.5 50.06 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.112 -0.993 . . . . 0.0 109.727 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.427 HG22 HD11 ' A' ' 25' ' ' ILE . 59.5 mt -103.86 118.29 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.303 -0.873 . . . . 0.0 109.709 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.422 HG13 ' OG1' ' A' ' 15' ' ' THR . 29.7 m -137.48 89.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.106 -0.996 . . . . 0.0 111.251 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 tttm 60.3 149.45 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.081 -1.012 . . . . 0.0 111.318 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.13 9.18 80.25 Favored Glycine 0 N--CA 1.496 2.678 0 C-N-CA 120.245 -0.978 . . . . 0.0 111.712 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 80.1 t -127.6 135.17 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-N 119.712 1.756 . . . . 0.0 110.247 -179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 5.7 t -87.47 120.96 29.3 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.6 mtm180 -101.69 129.8 47.93 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.939 -178.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 18.9 mt -103.82 131.06 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.13 126.0 8.77 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 40.4 tttt -107.48 116.99 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.289 -1.124 . . . . 0.0 109.741 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.87 111.96 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.097 -1.002 . . . . 0.0 110.106 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 73.7 t -120.37 113.64 33.63 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.247 -0.908 . . . . 0.0 109.794 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.35 147.24 46.76 Favored 'Trans proline' 0 N--CA 1.485 1.018 0 O-C-N 123.202 1.106 . . . . 0.0 110.47 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -102.89 163.7 17.02 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.327 -0.858 . . . . 0.0 110.233 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.28 70.92 3.08 Favored 'Trans proline' 0 C--N 1.317 -1.085 0 O-C-N 123.357 1.188 . . . . 0.0 110.411 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -152.61 -58.27 0.14 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.127 -0.983 . . . . 0.0 110.428 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 30.4 t -108.97 157.52 18.57 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.264 -0.898 . . . . 0.0 110.173 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -99.48 -45.03 5.96 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.165 -0.959 . . . . 0.0 110.409 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.14 -40.39 13.79 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.13 -0.981 . . . . 0.0 110.032 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.58 -167.8 19.32 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.47 41.7 5.37 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -122.02 143.29 49.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.198 -1.177 . . . . 0.0 110.271 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -117.15 129.66 56.11 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.244 -0.91 . . . . 0.0 110.26 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -122.99 136.0 54.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -139.76 155.8 47.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.131 -0.981 . . . . 0.0 109.923 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 51.8 m95 -98.11 163.01 12.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.185 -0.947 . . . . 0.0 110.138 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -143.66 172.69 12.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.265 -0.897 . . . . 0.0 110.683 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -91.71 -172.07 3.09 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.517 HG23 ' NE2' ' A' ' 93' ' ' HIS . 44.6 mm -83.38 -47.1 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 C-N-CA 119.117 -1.033 . . . . 0.0 109.047 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.7 mtmt -80.22 -32.89 38.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.798 -1.189 . . . . 0.0 110.717 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.8 m -62.67 -50.92 69.28 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.939 -1.101 . . . . 0.0 110.235 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.0 tpt -68.0 -42.22 81.08 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.842 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.431 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 9.8 m-85 -69.27 -30.71 68.88 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.647 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.61 -37.82 85.36 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.962 -1.086 . . . . 0.0 109.417 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -58.18 -39.19 78.26 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.027 -1.046 . . . . 0.0 109.903 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.7 mp -58.1 -41.78 84.28 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.154 -0.966 . . . . 0.0 109.346 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -57.95 -34.12 69.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.236 -0.915 . . . . 0.0 109.589 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -104.4 30.46 5.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.196 -0.94 . . . . 0.0 110.525 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -107.68 168.34 9.32 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.892 -1.13 . . . . 0.0 110.071 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -78.92 157.36 28.24 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.247 -0.908 . . . . 0.0 110.178 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -83.67 -33.41 25.21 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.257 -0.902 . . . . 0.0 110.707 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.42 -36.2 32.0 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.924 -1.11 . . . . 0.0 110.873 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 m -109.8 148.29 31.73 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.133 -0.979 . . . . 0.0 109.883 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -116.39 139.54 50.32 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.161 -0.962 . . . . 0.0 110.478 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.69 130.41 56.32 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.178 -0.951 . . . . 0.0 109.918 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.4 mt 54.97 99.21 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 O-C-N 121.126 -0.984 . . . . 0.0 110.469 -179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -109.49 139.91 43.9 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.156 -0.965 . . . . 0.0 110.31 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.17 -176.73 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.092 -1.005 . . . . 0.0 110.896 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.459 ' CD2' ' OG1' ' A' ' 91' ' ' THR . 15.0 tp -98.73 -29.65 12.89 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.25 42.88 1.08 Allowed 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.779 -1.201 . . . . 0.0 110.404 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -122.06 34.7 5.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.142 -0.974 . . . . 0.0 110.192 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.4 ' O ' ' CD1' ' A' ' 79' ' ' TRP . 57.3 mt -145.8 153.71 41.22 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.05 -1.031 . . . . 0.0 109.963 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -85.13 116.37 23.46 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.046 -1.034 . . . . 0.0 110.442 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 148.49 -40.92 0.9 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.744 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.4 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 48.9 p-90 -61.93 -26.1 67.98 Favored 'General case' 0 N--CA 1.513 2.684 0 O-C-N 121.069 -1.253 . . . . 0.0 111.538 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -53.05 -28.04 22.75 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 120.788 -1.195 . . . . 0.0 111.465 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -112.77 28.45 8.78 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.809 -1.182 . . . . 0.0 112.116 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.423 HD12 ' CD2' ' A' ' 10' ' ' TYR . 25.8 mt -109.76 -166.1 1.07 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.714 -1.242 . . . . 0.0 109.918 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -97.74 162.83 13.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.101 -0.999 . . . . 0.0 110.333 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -81.96 -39.89 23.02 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.212 -0.93 . . . . 0.0 110.306 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -61.85 -50.54 71.86 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.19 -0.944 . . . . 0.0 109.596 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.415 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 10.7 mt-10 -61.75 -41.49 97.73 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.289 -0.882 . . . . 0.0 109.227 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -59.17 -34.36 72.02 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.259 -0.901 . . . . 0.0 110.208 179.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.71 -35.3 76.99 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.053 -1.029 . . . . 0.0 110.236 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.04 -41.32 77.81 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.969 -1.082 . . . . 0.0 110.201 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 4.5 tt -65.04 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.223 179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.459 ' OG1' ' CD2' ' A' ' 73' ' ' LEU . 0.3 OUTLIER -65.4 -40.01 92.92 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.846 -1.159 . . . . 0.0 109.317 178.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -35.33 63.56 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.277 -0.89 . . . . 0.0 110.247 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.517 ' NE2' HG23 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -56.8 -47.29 80.55 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 121.037 -1.04 . . . . 0.0 109.922 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.431 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 16.6 mt -63.63 -37.48 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.114 -0.991 . . . . 0.0 109.724 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.09 -39.56 95.08 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.144 -0.973 . . . . 0.0 109.664 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.13 -36.8 69.5 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.2 -0.937 . . . . 0.0 109.801 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.2 tp -79.76 -30.95 40.88 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.179 -0.951 . . . . 0.0 110.584 179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 66.9 m -93.08 -38.14 11.78 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.835 -1.165 . . . . 0.0 110.349 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.66 91.72 3.77 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.127 -0.983 . . . . 0.0 110.157 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -123.72 161.95 24.11 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.17 -0.956 . . . . 0.0 110.151 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.58 159.88 30.99 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.184 -0.947 . . . . 0.0 110.197 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.2 113.59 8.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.157 -0.965 . . . . 0.0 110.195 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 108.36 -74.41 0.21 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 16.7 p -119.89 153.37 54.86 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.127 -1.219 . . . . 0.0 110.285 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.92 97.08 0.88 Allowed 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.384 1.202 . . . . 0.0 110.443 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -125.95 145.31 50.34 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.177 -0.952 . . . . 0.0 110.249 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -122.37 134.57 54.62 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.27 -0.894 . . . . 0.0 110.253 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.1 tptm -119.0 134.46 55.18 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.16 -0.963 . . . . 0.0 110.189 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.74 164.88 14.33 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.232 -0.918 . . . . 0.0 110.267 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.4 t -121.8 117.0 51.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.222 -0.924 . . . . 0.0 109.983 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 9.2 p -138.04 142.88 34.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.246 -0.909 . . . . 0.0 110.213 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -130.6 107.73 9.4 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.202 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -123.07 140.71 52.75 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.233 -0.917 . . . . 0.0 110.289 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -121.0 104.62 9.94 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.256 -0.903 . . . . 0.0 110.214 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.4 mt -126.45 139.01 53.58 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.175 -0.953 . . . . 0.0 110.211 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.9 p -123.43 111.81 16.79 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.178 -0.951 . . . . 0.0 110.222 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 10.8 m . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.242 179.971 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.6 mtm . . . . . 0 N--CA 1.491 1.625 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.88 79.19 1.64 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.156 -0.965 . . . . 0.0 110.309 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -118.03 -57.56 2.08 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.162 -0.961 . . . . 0.0 110.099 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -115.82 126.14 53.6 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.274 -0.892 . . . . 0.0 110.154 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -123.64 125.95 45.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.191 -0.943 . . . . 0.0 110.414 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.448 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -116.72 137.39 52.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.264 -0.898 . . . . 0.0 109.894 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.4 t -125.89 154.34 42.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 109.138 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 28.9 m -129.44 143.33 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.954 -1.091 . . . . 0.0 110.326 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -158.22 138.15 12.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.185 -0.947 . . . . 0.0 110.986 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.455 ' OH ' ' CB ' ' A' ' 86' ' ' GLU . 1.7 m-85 -53.53 155.73 2.86 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 121.093 -1.004 . . . . 0.0 110.424 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -88.17 150.98 23.01 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 119.535 -0.866 . . . . 0.0 109.652 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -105.05 -163.64 0.97 Allowed 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.16 -0.963 . . . . 0.0 110.337 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -89.51 61.24 5.48 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.159 -0.963 . . . . 0.0 110.037 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -130.27 -164.88 11.45 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.315 -1.514 . . . . 0.0 109.315 179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 p -117.94 110.81 18.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.299 -1.118 . . . . 0.0 110.012 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.51 99.35 5.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.129 -0.982 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.36 119.29 13.85 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.0 t -59.79 128.94 39.41 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.195 -1.18 . . . . 0.0 109.83 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -62.2 148.76 43.65 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.111 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt 52.71 45.05 29.45 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.991 -1.068 . . . . 0.0 109.647 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.4 t -164.74 153.45 12.6 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.35 -0.844 . . . . 0.0 110.742 -178.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.89 48.4 0.86 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.261 -0.899 . . . . 0.0 108.582 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -144.48 -174.65 4.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.467 -0.77 . . . . 0.0 110.286 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.85 157.08 44.95 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.186 -0.946 . . . . 0.0 109.871 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.429 HG12 ' NE2' ' A' ' 52' ' ' HIS . 38.3 mt -110.56 113.51 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 109.579 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 62.1 t -134.33 90.19 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.06 -1.025 . . . . 0.0 110.569 -179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.87 134.6 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.348 -0.845 . . . . 0.0 111.194 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.96 -24.12 33.6 Favored Glycine 0 N--CA 1.495 2.601 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.19 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 57.9 t -114.38 136.95 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 CA-C-N 119.262 1.531 . . . . 0.0 110.373 -179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.27 139.5 39.84 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.4 -0.92 . . . . 0.0 108.851 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 44.0 mtm-85 -107.82 137.28 46.1 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.109 -0.995 . . . . 0.0 110.811 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 4.5 mt -109.01 125.13 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 179.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.6 122.28 7.46 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.656 -1.377 . . . . 0.0 109.656 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.448 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.6 ttpm? -104.45 113.07 26.39 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.414 -1.05 . . . . 0.0 109.469 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.0 t -97.45 107.21 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.174 -0.954 . . . . 0.0 110.04 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.7 p -124.66 143.27 42.99 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -74.03 151.55 44.82 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 O-C-N 123.209 1.11 . . . . 0.0 110.412 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -102.37 164.07 16.43 Favored Pre-proline 0 N--CA 1.5 2.034 0 O-C-N 121.303 -0.873 . . . . 0.0 110.102 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.5 -40.0 3.28 Favored 'Trans proline' 0 C--N 1.316 -1.177 0 O-C-N 123.404 1.213 . . . . 0.0 110.496 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -141.34 110.97 6.46 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.155 -0.966 . . . . 0.0 110.267 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.1 m -129.4 133.65 47.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.147 -0.971 . . . . 0.0 110.134 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -102.41 -47.25 4.54 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.266 -0.896 . . . . 0.0 110.65 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 p -88.49 -39.89 13.86 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.1 -1.0 . . . . 0.0 110.562 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -121.55 -163.57 12.0 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.87 -1.292 . . . . 0.0 109.87 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -140.79 -60.49 0.03 OUTLIER Glycine 0 N--CA 1.495 2.576 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -108.48 146.58 32.96 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.202 -1.175 . . . . 0.0 110.004 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.3 mtt -115.62 144.49 43.83 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.574 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -123.1 129.63 51.72 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.265 -0.897 . . . . 0.0 109.99 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -125.26 159.31 31.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.152 -0.968 . . . . 0.0 110.209 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -104.31 134.13 48.05 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.241 -0.912 . . . . 0.0 110.017 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -116.25 173.0 6.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.255 -0.903 . . . . 0.0 110.714 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.429 ' NE2' HG12 ' A' ' 25' ' ' ILE . 1.1 m170 -93.26 -171.79 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.464 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 49.3 mm -85.63 -45.0 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 C-N-CA 118.943 -1.103 . . . . 0.0 109.004 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -21.66 29.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.042 -1.037 . . . . 0.0 111.341 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.5 m -78.24 -41.69 33.5 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.753 -1.217 . . . . 0.0 109.759 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.35 -38.15 60.25 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.743 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.512 ' CD1' ' NE2' ' A' ' 93' ' ' HIS . 11.4 m-85 -71.76 -30.22 65.35 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.677 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -61.16 -37.01 81.36 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.921 -1.112 . . . . 0.0 109.497 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -58.87 -40.08 83.28 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.029 -1.044 . . . . 0.0 109.826 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.4 mp -58.96 -42.93 91.07 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.187 -0.946 . . . . 0.0 109.305 179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -57.74 -34.14 69.2 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.296 -0.878 . . . . 0.0 109.68 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.05 29.68 5.75 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.212 -0.93 . . . . 0.0 110.589 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -111.41 167.4 10.33 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.882 -1.136 . . . . 0.0 109.971 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 37.8 mtt85 -71.07 157.21 38.59 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.164 -0.96 . . . . 0.0 110.095 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.32 -34.34 28.59 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.148 -0.97 . . . . 0.0 110.567 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.2 p -51.53 -35.73 41.96 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.926 -1.109 . . . . 0.0 110.833 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.4 p -110.6 126.87 54.92 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.085 -1.009 . . . . 0.0 110.17 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -116.85 144.22 44.76 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.168 -0.957 . . . . 0.0 110.117 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -125.29 150.43 47.11 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.221 -0.924 . . . . 0.0 110.27 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.47 HD11 HG22 ' A' ' 70' ' ' ILE . 79.0 mt 53.6 96.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.162 -0.961 . . . . 0.0 110.76 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -115.69 133.06 56.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.135 -0.978 . . . . 0.0 109.936 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 51.49 -172.9 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.076 -1.015 . . . . 0.0 110.735 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.402 ' CD2' ' CG ' ' A' ' 87' ' ' LYS . 50.4 tp -117.19 84.33 2.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.134 -0.979 . . . . 0.0 110.397 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.91 -51.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.17 -0.956 . . . . 0.0 110.744 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -51.0 -30.87 16.34 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.113 -0.992 . . . . 0.0 111.23 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 30.8 mt -74.73 153.87 38.65 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.919 -1.113 . . . . 0.0 109.964 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -99.38 119.05 37.34 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.198 -0.939 . . . . 0.0 111.065 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.83 -38.81 1.46 Allowed Glycine 0 N--CA 1.495 2.567 0 N-CA-C 110.266 -1.133 . . . . 0.0 110.266 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.418 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 59.7 p-90 -51.39 -34.91 36.53 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.017 -1.284 . . . . 0.0 110.937 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.418 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 6.4 tt0 -54.79 -35.9 64.33 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.982 -1.074 . . . . 0.0 110.565 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -80.54 -36.8 32.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.034 -1.041 . . . . 0.0 110.286 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.418 ' HG ' ' CE2' ' A' ' 10' ' ' TYR . 7.2 mp -48.9 172.74 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.131 -0.98 . . . . 0.0 111.206 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -105.11 163.2 12.74 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.212 -0.93 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -52.42 -39.42 60.97 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.179 -0.95 . . . . 0.0 110.798 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.97 -52.13 65.28 Favored 'General case' 0 N--CA 1.508 2.455 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.635 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.455 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 14.0 tp10 -64.09 -40.97 97.38 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.435 -0.906 . . . . 0.0 109.065 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.402 ' CG ' ' CD2' ' A' ' 73' ' ' LEU . 33.3 tttt -63.99 -39.39 94.0 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.694 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.33 -40.73 97.31 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.58 -37.81 88.85 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.06 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 42.0 mm -64.86 -41.73 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 47.2 p -63.16 -47.08 84.19 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.426 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -64.25 -40.56 96.26 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.981 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.512 ' NE2' ' CD1' ' A' ' 57' ' ' PHE . 64.6 t60 -61.15 -43.55 98.7 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.417 ' CG1' ' CZ ' ' A' ' 57' ' ' PHE . 19.1 mt -70.44 -38.72 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 O-C-N 121.159 -0.963 . . . . 0.0 108.839 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.09 91.29 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.137 -0.977 . . . . 0.0 109.375 178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.77 -37.0 80.38 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.165 -0.959 . . . . 0.0 109.829 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.0 tp -88.07 -33.33 18.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.401 179.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.3 m -102.17 54.51 0.8 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.945 -1.097 . . . . 0.0 110.206 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -132.69 117.93 18.47 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.178 -0.951 . . . . 0.0 110.22 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -119.61 101.17 7.73 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.178 -0.951 . . . . 0.0 110.188 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.91 114.32 7.91 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.135 -0.978 . . . . 0.0 110.28 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -121.19 77.51 1.32 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.231 -0.918 . . . . 0.0 110.232 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -139.85 161.95 26.29 Favored Glycine 0 N--CA 1.493 2.491 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 m -118.48 94.24 46.96 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.14 -1.212 . . . . 0.0 110.153 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.3 -172.48 0.9 Allowed 'Trans proline' 0 C--N 1.317 -1.102 0 O-C-N 123.357 1.188 . . . . 0.0 110.482 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -116.13 -56.18 2.33 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.161 -0.962 . . . . 0.0 110.282 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.81 -166.09 1.06 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.115 -0.99 . . . . 0.0 110.148 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -118.52 -64.6 1.27 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.216 -0.927 . . . . 0.0 110.131 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.59 136.6 53.17 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.233 -0.917 . . . . 0.0 110.222 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 61.5 t -130.06 142.61 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.271 -0.893 . . . . 0.0 109.898 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.0 t -117.62 138.59 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.161 -0.962 . . . . 0.0 109.956 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -127.31 149.1 50.19 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.293 -0.879 . . . . 0.0 110.299 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.36 138.46 51.78 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.244 -0.91 . . . . 0.0 110.193 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -122.68 129.79 52.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.225 -0.922 . . . . 0.0 110.17 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 13.6 tp -118.84 105.05 11.12 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.131 -0.981 . . . . 0.0 110.273 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.3 m -122.48 122.06 38.04 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.142 -0.973 . . . . 0.0 110.214 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.495 1.794 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.212 -179.932 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.79 0.328 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -129.44 77.14 1.77 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.14 -0.975 . . . . 0.0 110.233 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -133.47 92.64 3.02 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.173 -0.955 . . . . 0.0 110.106 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -118.23 150.8 38.83 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.179 -0.951 . . . . 0.0 110.281 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 mmt-85 -116.29 134.17 55.2 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.232 -0.917 . . . . 0.0 110.039 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.423 ' CE2' ' HG3' ' A' ' 34' ' ' LYS . 1.3 m-85 -116.99 144.99 43.94 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.169 -0.957 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.0 t -131.56 153.09 50.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.351 -0.843 . . . . 0.0 108.952 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 24.2 m -126.95 132.0 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 O-C-N 120.994 -1.066 . . . . 0.0 110.568 179.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -147.68 159.63 43.57 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.087 -1.008 . . . . 0.0 110.561 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.42 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -100.41 155.74 17.65 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.453 -0.78 . . . . 0.0 109.968 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -107.61 138.68 43.39 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.361 -0.837 . . . . 0.0 110.292 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 tttt -150.23 127.73 11.51 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.248 -0.907 . . . . 0.0 110.605 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 ttt85 54.71 99.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.093 -1.004 . . . . 0.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.86 -151.41 23.55 Favored Glycine 0 N--CA 1.496 2.665 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -158.02 138.44 12.72 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.195 -1.179 . . . . 0.0 110.593 -179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.98 107.16 4.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.157 -0.964 . . . . 0.0 110.539 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.67 114.72 7.13 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 24.6 t -61.06 128.49 36.71 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.207 -1.172 . . . . 0.0 109.521 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.419 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 19.1 tptt -61.8 148.09 44.27 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.196 -0.94 . . . . 0.0 109.091 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.3 mttt 52.74 45.62 28.35 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.946 -1.096 . . . . 0.0 109.669 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.8 t -165.21 154.08 12.21 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.362 -0.836 . . . . 0.0 110.783 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -105.5 44.04 1.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -141.43 -177.11 4.99 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.015 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -126.71 161.68 27.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.019 -1.051 . . . . 0.0 110.264 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.417 HG12 ' CD2' ' A' ' 52' ' ' HIS . 7.1 mt -120.17 102.92 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.409 -0.807 . . . . 0.0 109.997 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.5 p -162.32 143.93 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.24 -0.913 . . . . 0.0 111.266 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.9 tptp 52.84 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.261 -0.9 . . . . 0.0 111.558 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.51 9.31 83.59 Favored Glycine 0 N--CA 1.496 2.652 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.061 179.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 58.9 t -124.49 135.14 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 119.891 1.846 . . . . 0.0 110.582 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.4 t -102.0 140.01 36.87 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.301 -0.875 . . . . 0.0 108.767 178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.23 150.33 50.65 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.124 -0.985 . . . . 0.0 111.401 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 19.2 mt -110.81 138.27 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.444 -0.785 . . . . 0.0 108.997 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.12 125.89 8.56 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.165 -1.574 . . . . 0.0 109.165 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.423 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 22.0 ttmt -107.51 120.54 42.47 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.238 -1.154 . . . . 0.0 109.804 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.5 t -101.63 107.5 21.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.058 -1.026 . . . . 0.0 110.28 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.4 p -124.66 143.5 43.66 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.96 126.36 11.2 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 O-C-N 123.089 1.047 . . . . 0.0 110.228 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -105.1 117.79 57.66 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.165 -0.959 . . . . 0.0 110.231 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -74.84 70.0 5.27 Favored 'Trans proline' 0 N--CA 1.485 0.998 0 O-C-N 123.193 1.102 . . . . 0.0 110.313 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -148.17 -58.93 0.24 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.113 -0.992 . . . . 0.0 110.449 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 21.8 p -108.68 157.39 18.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.228 -0.92 . . . . 0.0 110.178 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -95.97 -39.62 9.68 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.228 -0.92 . . . . 0.0 110.41 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.9 t -58.28 -40.14 81.13 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.047 -1.033 . . . . 0.0 110.109 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -108.77 75.34 0.21 Allowed Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.371 -1.491 . . . . 0.0 109.371 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.76 -45.43 96.25 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -115.78 138.85 50.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.259 -1.142 . . . . 0.0 110.257 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.6 ttt -117.25 143.62 45.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.221 -0.924 . . . . 0.0 110.385 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -117.99 128.51 54.85 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.249 -0.907 . . . . 0.0 110.139 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -122.95 148.59 45.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.21 -0.931 . . . . 0.0 109.777 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 23.4 m95 -94.23 163.25 13.52 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.137 -0.977 . . . . 0.0 109.94 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.419 ' CE1' ' HB3' ' A' ' 19' ' ' LYS . 89.0 m-85 -146.29 174.82 11.01 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.307 -0.871 . . . . 0.0 110.459 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.417 ' CD2' HG12 ' A' ' 25' ' ' ILE . 1.8 m80 -99.44 -175.79 3.1 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.331 -0.855 . . . . 0.0 108.831 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.508 HG23 ' NE2' ' A' ' 93' ' ' HIS . 49.8 mm -83.98 -34.34 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 O-C-N 121.076 -1.015 . . . . 0.0 109.582 178.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -91.38 -32.45 15.65 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.695 -1.253 . . . . 0.0 110.594 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.9 m -63.46 -52.38 61.65 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.959 -1.088 . . . . 0.0 110.744 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 11.7 tpt -67.76 -38.27 83.23 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.42 -179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.427 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 13.2 m-85 -76.77 -27.0 55.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.015 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -75.21 -37.12 61.27 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.836 -1.165 . . . . 0.0 109.407 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -40.85 82.32 Favored 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.31 179.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 tp -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.405 -0.809 . . . . 0.0 109.606 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -70.31 -33.32 71.38 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.181 -0.949 . . . . 0.0 110.424 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -30.62 21.31 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.11 -0.994 . . . . 0.0 111.059 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -107.88 99.82 9.24 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.877 -1.139 . . . . 0.0 110.434 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -121.34 104.45 9.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.288 -0.883 . . . . 0.0 109.802 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -87.3 -37.23 17.35 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.166 -0.959 . . . . 0.0 110.685 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -172.38 -51.91 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.145 -0.972 . . . . 0.0 111.035 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.43 160.81 17.38 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.157 -0.964 . . . . 0.0 110.475 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -99.34 146.87 25.8 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.26 -0.9 . . . . 0.0 110.019 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -101.15 160.1 14.68 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.2 -0.937 . . . . 0.0 110.305 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.7 mt 55.69 99.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.179 -0.951 . . . . 0.0 110.538 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.55 143.62 44.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.205 -0.934 . . . . 0.0 110.001 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.26 -172.33 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.093 -1.005 . . . . 0.0 110.423 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.403 ' CD2' ' CG ' ' A' ' 87' ' ' LYS . 13.2 tp -122.54 37.38 4.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.218 -0.926 . . . . 0.0 110.71 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -144.42 36.56 1.21 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.085 -1.01 . . . . 0.0 110.404 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -134.98 33.53 3.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.245 -0.909 . . . . 0.0 110.101 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.4 ' CD2' ' HB3' ' A' ' 6' ' ' PHE . 55.2 mt -138.91 156.36 47.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.093 -1.004 . . . . 0.0 109.729 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -86.55 104.66 16.2 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.167 -0.958 . . . . 0.0 110.875 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.97 -30.12 2.28 Favored Glycine 0 N--CA 1.495 2.604 0 C-N-CA 119.519 -1.324 . . . . 0.0 111.806 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.435 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 19.0 p-90 -57.65 -34.23 69.13 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 119.492 1.646 . . . . 0.0 110.761 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.435 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 23.5 tt0 -55.78 -35.61 66.46 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.943 -1.098 . . . . 0.0 110.487 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -74.49 -32.77 62.65 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.03 -1.044 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.8 174.44 0.02 OUTLIER 'General case' 0 N--CA 1.519 2.979 0 O-C-N 120.971 -1.081 . . . . 0.0 110.913 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -105.43 161.77 14.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.175 -0.953 . . . . 0.0 110.452 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.54 -50.12 74.91 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.226 -0.921 . . . . 0.0 110.347 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -61.18 -37.2 82.06 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.238 -0.914 . . . . 0.0 110.203 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 55.4 mt-10 -73.27 -41.22 63.88 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.132 -0.98 . . . . 0.0 108.805 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.403 ' CG ' ' CD2' ' A' ' 73' ' ' LEU . 34.7 tttt -58.89 -34.86 72.13 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.372 -0.83 . . . . 0.0 109.949 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -65.13 -35.6 81.62 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.091 -1.006 . . . . 0.0 109.987 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -67.51 -47.31 70.33 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.981 -1.074 . . . . 0.0 110.083 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.2 tt -63.98 -34.43 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.437 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.823 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -63.35 -39.38 94.39 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.912 -1.117 . . . . 0.0 109.179 178.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -55.77 -38.63 70.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.141 -0.974 . . . . 0.0 109.969 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.508 ' NE2' HG23 ' A' ' 53' ' ' ILE . 2.4 m-70 -60.69 -53.33 58.69 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.196 -0.94 . . . . 0.0 109.837 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.427 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.6 mt -61.94 -38.73 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.484 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.24 93.18 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.156 -0.965 . . . . 0.0 109.508 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.53 -43.4 76.82 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.234 -0.916 . . . . 0.0 108.797 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 13.6 tp -60.56 -34.97 74.94 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.282 -0.886 . . . . 0.0 109.962 179.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.7 m -98.14 50.91 1.02 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.088 -1.007 . . . . 0.0 110.116 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.428 ' OG ' ' N ' ' A' ' 100' ' ' LYS . 9.5 t -118.55 -171.76 2.15 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.125 -0.985 . . . . 0.0 110.056 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.428 ' N ' ' OG ' ' A' ' 99' ' ' SER . 10.2 mttp -134.41 40.37 3.0 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.162 -0.961 . . . . 0.0 110.211 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -143.34 130.15 20.42 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.286 -0.884 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.53 42.91 1.62 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.193 -0.942 . . . . 0.0 110.346 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 105.42 -71.83 0.23 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 18.7 p -117.68 157.74 47.15 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.282 -1.128 . . . . 0.0 110.28 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.54 122.2 8.07 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.394 1.207 . . . . 0.0 110.361 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.8 mttp -120.57 41.16 3.32 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.237 -0.914 . . . . 0.0 110.154 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 17.7 tttp 52.68 71.66 0.46 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.06 -1.025 . . . . 0.0 110.751 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm -119.76 81.64 1.76 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.126 -0.984 . . . . 0.0 110.218 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -127.84 111.0 13.14 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.206 -0.934 . . . . 0.0 110.222 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.5 t -115.3 100.42 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.189 -0.945 . . . . 0.0 109.918 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.3 t -126.14 143.43 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.193 -0.942 . . . . 0.0 109.957 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -114.57 87.94 2.75 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.273 -0.892 . . . . 0.0 110.166 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.47 140.44 52.77 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.222 -0.924 . . . . 0.0 110.243 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.8 ttpt -117.09 107.1 14.09 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.192 -0.943 . . . . 0.0 110.224 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.5 tt -125.88 108.76 11.76 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.272 -0.892 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.7 m -121.53 147.43 45.81 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.202 -0.936 . . . . 0.0 110.228 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.2 p . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.233 179.945 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 ttt . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.98 130.91 53.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.282 -0.886 . . . . 0.0 110.282 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -127.96 -66.02 0.88 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.165 -0.959 . . . . 0.0 110.253 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -152.04 134.66 15.41 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.176 -0.952 . . . . 0.0 110.606 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -125.08 143.99 50.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.208 -0.933 . . . . 0.0 110.165 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.413 ' CE2' ' HD2' ' A' ' 34' ' ' LYS . 1.7 m-85 -118.78 149.57 41.27 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.289 -0.882 . . . . 0.0 110.209 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.4 m -135.41 164.81 26.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.254 -0.904 . . . . 0.0 109.421 179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 3.9 p -139.29 112.87 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.053 -1.03 . . . . 0.0 110.231 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -125.77 142.97 51.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 109.699 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.423 ' CD1' ' HB3' ' A' ' 82' ' ' LEU . 95.9 m-85 -99.6 137.75 37.65 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.229 -0.919 . . . . 0.0 109.667 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.58 134.66 46.72 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.043 -1.036 . . . . 0.0 110.742 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 32.4 tttt -119.63 -58.02 1.93 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.239 -0.913 . . . . 0.0 110.014 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -147.82 38.61 0.92 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.219 -0.925 . . . . 0.0 110.513 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -146.92 157.56 27.45 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.4 p -140.53 140.73 35.28 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.21 -1.171 . . . . 0.0 110.205 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -161.0 151.12 17.56 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.206 -0.934 . . . . 0.0 111.398 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -54.46 127.02 38.74 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 108.822 -1.711 . . . . 0.0 108.822 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.462 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 23.4 p -64.53 127.9 33.49 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.272 -1.134 . . . . 0.0 110.826 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.426 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 1.2 mptm? -75.82 156.51 34.39 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.52 -0.738 . . . . 0.0 109.308 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 tptp 65.89 16.25 10.4 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.904 -1.122 . . . . 0.0 111.529 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.3 p -174.83 149.14 1.14 Allowed 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.572 -1.33 . . . . 0.0 110.646 178.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 tttt -85.07 88.84 7.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.986 -1.071 . . . . 0.0 111.776 -177.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -166.97 -174.56 2.73 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.277 -0.889 . . . . 0.0 110.408 178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.09 152.73 47.63 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.039 -1.038 . . . . 0.0 109.656 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.9 mt -105.25 118.82 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.344 -0.847 . . . . 0.0 110.024 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.2 t -115.65 159.0 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.228 -0.92 . . . . 0.0 109.96 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -49.99 132.94 23.1 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.28 -0.888 . . . . 0.0 110.752 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.37 9.7 40.76 Favored Glycine 0 N--CA 1.494 2.531 0 C-N-CA 120.083 -1.056 . . . . 0.0 111.591 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.8 p -123.65 135.13 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 CA-C-N 119.682 1.741 . . . . 0.0 110.536 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.412 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 23.8 p -87.01 141.59 28.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.229 -0.92 . . . . 0.0 110.239 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -138.85 144.52 39.26 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -0.943 . . . . 0.0 110.349 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.411 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 12.2 mt -106.51 126.9 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.222 -0.924 . . . . 0.0 109.277 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.0 133.74 11.54 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.251 -1.539 . . . . 0.0 109.251 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.441 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 33.0 tttt -103.77 121.83 43.83 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.159 -1.201 . . . . 0.0 109.298 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.97 112.6 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.154 -0.966 . . . . 0.0 110.411 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.3 t -120.37 141.4 31.86 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.141 -0.975 . . . . 0.0 109.727 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -74.63 129.64 12.89 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.259 1.137 . . . . 0.0 110.431 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -103.55 156.96 34.81 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.149 -0.969 . . . . 0.0 110.107 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.95 110.63 3.08 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 O-C-N 123.432 1.227 . . . . 0.0 110.407 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 54.35 98.78 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.0 -1.062 . . . . 0.0 110.774 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.0 m -111.84 156.36 22.13 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.195 -0.941 . . . . 0.0 110.203 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -101.84 -45.4 5.23 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.288 -0.883 . . . . 0.0 110.759 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.0 t -88.15 -44.15 11.11 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.052 -1.03 . . . . 0.0 110.454 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -147.74 135.42 5.57 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.74 -38.98 96.06 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -107.6 146.96 31.25 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.228 -1.16 . . . . 0.0 110.068 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.4 ttm -117.08 151.51 36.66 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.187 -0.946 . . . . 0.0 110.608 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.423 ' HD2' ' CZ2' ' A' ' 50' ' ' TRP . 7.8 pttt -131.71 142.7 49.87 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.341 -0.849 . . . . 0.0 109.905 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -120.8 134.23 55.3 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.102 -0.999 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.423 ' CZ2' ' HD2' ' A' ' 48' ' ' LYS . 17.0 m95 -91.56 114.47 27.01 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.074 -1.016 . . . . 0.0 110.591 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.441 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.8 OUTLIER -125.44 171.0 10.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.611 177.803 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.462 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 71.0 m80 -87.74 -173.5 4.34 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.49 -0.756 . . . . 0.0 110.028 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.452 HG23 ' CD2' ' A' ' 93' ' ' HIS . 30.8 mm -84.61 -52.75 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -60.22 -37.85 81.57 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.222 -0.924 . . . . 0.0 109.259 178.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -61.49 -51.29 69.26 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.25 -0.906 . . . . 0.0 109.083 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.412 ' HB2' ' CD1' ' A' ' 51' ' ' TYR . 9.0 tpt -68.94 -44.41 73.1 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.339 -0.851 . . . . 0.0 109.302 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 10.6 m-85 -64.12 -29.72 70.83 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 119.157 -1.017 . . . . 0.0 109.721 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.48 -40.09 85.86 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.989 -1.069 . . . . 0.0 109.391 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -66.22 -40.17 90.1 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.236 -0.915 . . . . 0.0 109.114 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.6 mp -57.8 -42.18 83.65 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.205 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -58.84 -35.65 73.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.221 -0.924 . . . . 0.0 109.53 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -105.23 30.56 5.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.228 -0.92 . . . . 0.0 110.457 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -116.96 168.84 9.88 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.022 -1.049 . . . . 0.0 110.072 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -62.64 152.95 33.79 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.169 -0.957 . . . . 0.0 109.999 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.42 -34.67 20.08 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.183 -0.948 . . . . 0.0 110.628 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.45 -36.1 42.58 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.988 -1.07 . . . . 0.0 110.876 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 m -111.2 114.04 26.97 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.079 -1.013 . . . . 0.0 110.181 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.97 144.98 43.94 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.181 -0.949 . . . . 0.0 110.181 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.07 153.92 28.61 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.188 -0.945 . . . . 0.0 110.263 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.42 HG22 HD11 ' A' ' 70' ' ' ILE . 77.7 mt 54.49 100.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.079 0 O-C-N 121.197 -0.939 . . . . 0.0 110.804 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -107.02 134.09 50.69 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.126 -0.984 . . . . 0.0 109.577 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 53.83 -163.65 0.1 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.996 -1.065 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.1 tp -103.87 73.87 1.19 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.984 -1.073 . . . . 0.0 109.811 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.85 -160.0 0.32 Allowed 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.182 -0.949 . . . . 0.0 110.406 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 54.6 38.89 30.7 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.911 -1.118 . . . . 0.0 110.238 -179.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.1 tp -141.85 150.92 42.22 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.304 -0.873 . . . . 0.0 109.412 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -100.89 104.47 15.68 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.137 -0.977 . . . . 0.0 110.829 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.78 -37.97 1.61 Allowed Glycine 0 N--CA 1.493 2.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.51 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -62.15 -28.18 69.47 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.931 -1.335 . . . . 0.0 111.022 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -51.42 -32.27 25.87 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.853 -1.154 . . . . 0.0 111.87 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -165.1 50.94 0.11 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.62 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.423 ' HB3' ' CD1' ' A' ' 10' ' ' TYR . 18.0 mt -118.31 -67.73 0.97 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.842 -1.162 . . . . 0.0 109.604 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.421 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 5.1 tp10 -121.0 127.81 52.12 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.143 -0.973 . . . . 0.0 109.815 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.4 -50.33 6.18 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.079 -1.013 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.49 -46.43 88.49 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.193 -0.942 . . . . 0.0 109.628 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -62.76 -36.92 84.63 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.438 -0.905 . . . . 0.0 109.722 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.6 ttpt -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.141 -0.974 . . . . 0.0 109.793 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.61 -41.73 97.87 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.18 -0.95 . . . . 0.0 109.558 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -61.01 -36.2 78.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.234 -0.916 . . . . 0.0 110.181 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 44.9 mt -60.11 -38.04 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.081 -1.012 . . . . 0.0 109.775 179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -39.91 86.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 120.905 -1.122 . . . . 0.0 109.771 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -59.66 -38.38 81.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 109.737 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.452 ' CD2' HG23 ' A' ' 53' ' ' ILE . 20.7 m-70 -56.46 -47.18 79.71 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.157 -0.964 . . . . 0.0 110.137 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -64.88 -39.75 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.182 179.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.38 -40.43 81.39 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.16 -0.962 . . . . 0.0 109.383 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -64.25 -40.17 95.46 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.251 -0.906 . . . . 0.0 109.515 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.2 tp -71.09 -33.38 70.12 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.247 -0.908 . . . . 0.0 110.233 179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 40.3 t -102.76 40.06 1.43 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.047 -1.033 . . . . 0.0 110.171 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 7.6 t -164.91 132.33 3.1 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.177 -0.952 . . . . 0.0 110.842 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -123.06 -65.38 1.1 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.183 -0.948 . . . . 0.0 110.247 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -143.38 -165.3 2.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.243 -0.911 . . . . 0.0 110.253 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -115.43 175.49 5.5 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.144 -0.972 . . . . 0.0 110.138 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -65.18 108.76 2.5 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.12 146.22 39.09 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.231 -1.158 . . . . 0.0 110.171 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.47 88.57 1.0 Allowed 'Trans proline' 0 C--N 1.319 -1.025 0 O-C-N 123.341 1.18 . . . . 0.0 110.402 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.4 tttp -143.53 142.4 31.11 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.5 mptt -122.76 147.4 46.55 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.267 -0.896 . . . . 0.0 110.143 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -131.24 -60.64 0.95 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.157 -0.964 . . . . 0.0 110.207 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -135.23 144.71 47.04 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.211 -0.93 . . . . 0.0 110.155 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 27.5 m -131.17 141.14 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.205 -0.935 . . . . 0.0 110.471 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.7 t -139.81 133.03 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.147 -0.97 . . . . 0.0 110.007 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -133.01 147.24 52.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.167 -0.958 . . . . 0.0 110.32 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -120.83 141.28 50.71 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.175 -0.953 . . . . 0.0 110.096 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -116.64 131.49 56.94 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.178 -0.951 . . . . 0.0 110.295 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.3 tt -120.16 112.79 19.53 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.203 -0.935 . . . . 0.0 110.247 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 21.3 m -117.77 105.45 11.98 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.202 -0.936 . . . . 0.0 110.22 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.7 p . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.205 179.995 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.04 161.7 35.35 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.243 -0.91 . . . . 0.0 110.203 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -140.45 -65.33 0.45 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.294 -0.879 . . . . 0.0 110.259 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -118.0 162.16 18.62 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.197 -0.94 . . . . 0.0 110.261 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -130.43 148.41 52.24 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.163 -0.961 . . . . 0.0 110.295 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.523 ' CE2' ' OH ' ' A' ' 51' ' ' TYR . 2.8 m-85 -114.09 153.48 29.4 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.316 -0.865 . . . . 0.0 110.25 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -135.69 124.68 24.24 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.438 -0.789 . . . . 0.0 109.318 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 20.5 m -101.16 134.57 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 O-C-N 121.222 -0.924 . . . . 0.0 110.736 -179.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -143.89 108.4 4.85 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.449 ' OH ' ' CB ' ' A' ' 86' ' ' GLU . 11.6 m-85 -56.08 158.85 3.68 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.105 -0.997 . . . . 0.0 110.304 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.32 119.01 32.46 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.363 -0.836 . . . . 0.0 110.007 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -111.14 -53.11 2.74 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.165 -0.96 . . . . 0.0 110.39 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -139.93 96.5 3.07 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.184 -0.947 . . . . 0.0 110.191 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 143.45 122.33 1.66 Allowed Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.8 p -115.78 144.2 44.32 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.198 -1.178 . . . . 0.0 109.875 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -154.86 151.49 28.66 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.219 -0.926 . . . . 0.0 111.228 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.98 125.19 32.45 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 108.696 -1.761 . . . . 0.0 108.696 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.465 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 23.8 p -63.85 126.96 29.3 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.198 -1.178 . . . . 0.0 110.892 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.423 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 37.8 mmtt -74.89 156.27 36.57 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.601 -0.687 . . . . 0.0 109.178 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.46 15.54 10.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.938 -1.101 . . . . 0.0 111.601 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.401 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 8.6 p -174.88 150.39 1.25 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.515 -1.366 . . . . 0.0 110.767 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 89.64 7.88 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.043 -1.036 . . . . 0.0 111.668 -178.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -167.02 -173.95 2.51 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.312 -0.867 . . . . 0.0 110.289 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -130.05 149.19 51.87 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.074 -1.016 . . . . 0.0 109.819 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.2 mt -101.24 120.74 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.194 -0.941 . . . . 0.0 109.711 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.8 t -108.57 157.02 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.233 -0.917 . . . . 0.0 110.061 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.3 mtpp -51.39 126.73 17.89 Favored 'General case' 0 N--CA 1.514 2.747 0 O-C-N 121.273 -0.892 . . . . 0.0 110.704 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 104.3 9.67 35.71 Favored Glycine 0 N--CA 1.496 2.649 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.843 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.6 p -113.78 135.03 54.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.783 1.792 . . . . 0.0 110.436 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.432 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.3 p -78.36 133.77 37.53 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.193 -0.942 . . . . 0.0 109.903 179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.3 ptt-85 -132.24 140.33 48.62 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.157 -0.964 . . . . 0.0 110.18 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.418 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 9.9 mt -107.83 125.24 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.26 -0.9 . . . . 0.0 109.447 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.57 144.86 15.89 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.443 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -119.43 135.21 54.85 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.118 -1.225 . . . . 0.0 109.453 179.336 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.7 t -111.98 111.78 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.943 -1.098 . . . . 0.0 110.241 -179.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.5 t -116.45 112.41 41.36 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.242 -0.912 . . . . 0.0 109.758 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.94 126.08 10.96 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 123.232 1.122 . . . . 0.0 110.503 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -105.37 118.57 55.4 Favored Pre-proline 0 N--CA 1.498 1.969 0 O-C-N 121.187 -0.946 . . . . 0.0 110.01 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.05 71.76 2.8 Favored 'Trans proline' 0 N--CA 1.485 1.024 0 O-C-N 123.147 1.077 . . . . 0.0 110.342 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -145.18 -59.12 0.35 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.092 -1.005 . . . . 0.0 110.331 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.4 t -108.35 156.98 18.79 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.153 -0.967 . . . . 0.0 110.181 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -97.58 -41.28 8.22 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.159 -0.963 . . . . 0.0 110.468 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 53.4 m -55.93 -39.32 71.5 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.003 -1.061 . . . . 0.0 110.333 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.16 -72.12 1.18 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.95 -77.31 2.14 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -132.45 143.62 49.91 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.183 -1.187 . . . . 0.0 110.264 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.7 mmm -117.84 135.43 54.09 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.222 -0.923 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.77 143.87 45.14 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.258 -0.901 . . . . 0.0 109.713 179.563 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -132.09 137.75 47.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.088 -1.007 . . . . 0.0 110.459 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 25.8 m95 -94.05 117.19 29.76 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.087 -1.008 . . . . 0.0 110.82 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.523 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.92 172.38 10.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.032 -1.042 . . . . 0.0 109.689 177.679 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.465 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.1 m80 -88.96 -173.11 3.95 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.335 -0.853 . . . . 0.0 110.238 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.461 HG22 HD11 ' A' ' 53' ' ' ILE . 23.0 mm -86.13 -50.77 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -61.87 -38.47 88.39 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.097 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.1 m -61.78 -50.94 70.32 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.172 -0.955 . . . . 0.0 108.98 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.411 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -67.28 -45.42 76.67 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.465 -0.772 . . . . 0.0 109.655 179.796 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.67 -28.65 68.63 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 119.214 -0.995 . . . . 0.0 110.023 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.09 -42.43 76.18 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 120.896 -1.128 . . . . 0.0 108.894 178.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -74.97 -42.32 57.83 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.8 tp -62.39 -38.89 91.38 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.407 -0.808 . . . . 0.0 109.143 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -67.03 -32.73 74.14 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.183 -0.948 . . . . 0.0 110.131 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -102.42 16.37 26.47 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.046 -1.034 . . . . 0.0 111.699 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.36 97.96 3.72 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.668 -1.27 . . . . 0.0 110.131 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.17 102.09 7.76 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.203 -0.935 . . . . 0.0 110.276 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.415 ' O ' ' OG1' ' A' ' 66' ' ' THR . . . -90.07 -38.81 13.31 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.205 -0.934 . . . . 0.0 110.22 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.415 ' OG1' ' O ' ' A' ' 65' ' ' ALA . 18.5 m -165.14 -55.3 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.193 -0.942 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.1 t -116.55 162.43 17.61 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.289 -0.882 . . . . 0.0 110.398 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -96.34 146.18 24.96 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.226 -0.921 . . . . 0.0 110.079 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -100.03 160.55 14.23 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.215 -0.928 . . . . 0.0 110.177 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.425 HG23 HD11 ' A' ' 70' ' ' ILE . 75.1 mt 55.28 99.22 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.147 -0.971 . . . . 0.0 110.613 -179.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -110.2 134.6 52.06 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.264 -0.898 . . . . 0.0 109.685 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.47 -164.75 0.09 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.059 -1.026 . . . . 0.0 110.206 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.423 HD23 ' OG1' ' A' ' 91' ' ' THR . 25.9 tp -121.7 53.84 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.08 -1.012 . . . . 0.0 110.765 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.42 37.03 0.47 Allowed 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.175 -0.953 . . . . 0.0 110.755 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -133.63 30.27 3.8 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.1 -1.0 . . . . 0.0 110.533 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 88.7 mt -134.08 154.68 51.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.015 -1.053 . . . . 0.0 109.722 179.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -86.2 104.01 15.35 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.194 -0.941 . . . . 0.0 110.502 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 148.2 -36.77 1.1 Allowed Glycine 0 N--CA 1.493 2.498 0 C-N-CA 119.766 -1.207 . . . . 0.0 110.893 179.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.459 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 17.3 p-90 -57.88 -35.23 70.7 Favored 'General case' 0 N--CA 1.509 2.511 0 CA-C-N 119.034 1.417 . . . . 0.0 110.838 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.459 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 1.9 tp10 -74.92 -29.38 60.95 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.021 -1.05 . . . . 0.0 110.862 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -99.01 -25.59 14.51 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.917 -1.114 . . . . 0.0 112.004 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.431 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 64.2 mt -76.21 -175.57 3.22 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.679 -1.263 . . . . 0.0 110.273 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -63.31 152.74 37.04 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.188 -0.945 . . . . 0.0 110.345 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -88.26 -40.18 13.85 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.189 -0.944 . . . . 0.0 110.22 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -60.17 -51.51 69.26 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.218 -0.926 . . . . 0.0 109.842 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.449 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 42.8 mt-10 -61.49 -40.0 92.99 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.254 -0.903 . . . . 0.0 109.326 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -59.56 -41.07 89.32 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.328 -0.857 . . . . 0.0 109.535 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -54.54 -33.6 60.37 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.209 -0.932 . . . . 0.0 110.364 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -57.63 -37.62 73.61 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.994 -1.066 . . . . 0.0 110.206 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 7.2 mt -62.36 -36.79 76.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.119 -0.988 . . . . 0.0 109.511 179.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.423 ' OG1' HD23 ' A' ' 73' ' ' LEU . 28.0 m -58.15 -38.13 76.01 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.899 -1.125 . . . . 0.0 109.6 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -57.79 -38.11 74.9 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.302 -0.874 . . . . 0.0 109.765 179.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.445 ' CD2' HG23 ' A' ' 53' ' ' ILE . 5.7 m-70 -58.56 -53.5 57.58 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -61.92 -38.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.396 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.95 92.67 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.176 -0.952 . . . . 0.0 109.774 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -60.94 -39.33 89.07 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.157 -0.964 . . . . 0.0 109.798 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.02 -34.58 68.94 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 110.349 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.5 t -101.07 62.84 0.98 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.025 -1.047 . . . . 0.0 110.197 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.1 t -132.5 40.18 3.31 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.144 -0.972 . . . . 0.0 110.223 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -141.63 134.2 28.38 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.085 -1.009 . . . . 0.0 110.227 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -141.32 123.55 15.65 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.13 -0.981 . . . . 0.0 110.248 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.24 77.99 1.56 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.211 -0.931 . . . . 0.0 110.189 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 71.42 133.81 0.12 Allowed Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.384 -1.487 . . . . 0.0 109.384 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 23.6 m -143.6 60.94 9.13 Favored Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.2 -1.177 . . . . 0.0 110.319 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.91 119.06 5.85 Favored 'Trans proline' 0 C--N 1.318 -1.079 0 O-C-N 123.365 1.192 . . . . 0.0 110.322 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -143.28 149.1 37.39 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.175 -0.953 . . . . 0.0 110.409 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -134.98 141.61 46.28 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.294 -0.879 . . . . 0.0 110.142 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -120.9 96.91 5.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.097 -1.002 . . . . 0.0 110.248 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -128.28 109.8 11.8 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.249 -0.907 . . . . 0.0 110.122 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.6 t -127.54 122.2 58.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.216 -0.928 . . . . 0.0 109.969 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.4 t -133.24 106.04 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.205 -0.934 . . . . 0.0 109.99 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -132.82 110.95 10.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.18 -0.95 . . . . 0.0 110.156 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.29 122.04 41.92 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.119 -0.988 . . . . 0.0 110.223 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 17.6 mttt -123.18 121.69 36.57 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.274 -0.891 . . . . 0.0 110.142 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.8 tp -117.74 137.04 52.97 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.211 -0.931 . . . . 0.0 110.222 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -141.63 111.18 6.49 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.309 -0.869 . . . . 0.0 110.131 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 25.1 m . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.198 179.944 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 ptt? . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.736 0.303 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -116.9 142.84 46.42 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.149 -0.969 . . . . 0.0 110.188 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -123.43 -61.45 1.4 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.239 -0.913 . . . . 0.0 110.267 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -134.95 116.43 14.7 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.217 -0.927 . . . . 0.0 110.194 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.1 mtp85 -120.06 145.66 46.65 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.185 -0.947 . . . . 0.0 110.273 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.506 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 1.4 m-85 -125.37 142.38 51.53 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.301 -0.874 . . . . 0.0 110.133 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.3 t -125.66 157.51 37.09 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.239 -0.913 . . . . 0.0 109.938 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 52.0 t -113.31 116.72 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.121 -0.987 . . . . 0.0 110.03 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.418 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 3.9 t70 -123.72 148.44 46.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.143 -0.973 . . . . 0.0 110.113 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.426 ' OH ' ' HB3' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -105.3 142.48 34.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.273 -0.892 . . . . 0.0 109.646 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.66 126.94 29.72 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.123 -0.986 . . . . 0.0 110.355 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -137.85 109.28 6.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.299 -0.876 . . . . 0.0 110.143 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 37.69 41.56 0.32 Allowed 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.62 164.77 26.62 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.3 m -144.4 122.43 12.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.124 -1.221 . . . . 0.0 110.347 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -153.21 139.44 18.43 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.185 -0.947 . . . . 0.0 111.133 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.99 129.13 49.1 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.906 -1.677 . . . . 0.0 108.906 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.438 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 32.0 p -66.79 119.84 12.51 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.156 -1.202 . . . . 0.0 111.118 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 12.6 mmtp -68.25 159.41 31.3 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.271 -0.893 . . . . 0.0 109.192 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 tptt 63.59 19.38 11.68 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.524 -1.36 . . . . 0.0 110.757 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.5 p -177.47 153.42 0.91 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 120.575 -1.328 . . . . 0.0 110.716 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -91.83 86.71 5.99 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.011 -1.055 . . . . 0.0 111.65 -178.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -165.51 -172.52 2.46 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.278 -0.889 . . . . 0.0 110.516 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.9 ttpt -127.65 155.9 43.18 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.139 -0.976 . . . . 0.0 109.978 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 70.5 mt -107.25 124.96 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.041 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.1 m -130.29 156.13 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.233 -0.917 . . . . 0.0 110.144 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ttpt -48.96 129.22 17.14 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.336 -0.853 . . . . 0.0 110.855 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 116.83 -8.26 16.84 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.573 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.3 p -125.09 134.85 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-N 119.795 1.797 . . . . 0.0 110.572 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 30.7 p -76.86 142.74 40.08 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.071 -1.018 . . . . 0.0 110.245 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.6 ptt180 -136.42 146.33 46.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.16 -0.962 . . . . 0.0 110.381 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.436 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 30.6 mt -113.81 132.69 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.287 -0.883 . . . . 0.0 109.902 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -108.8 155.5 16.08 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.437 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.0 ttpm? -118.26 130.74 56.23 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.187 -1.184 . . . . 0.0 109.781 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.7 t -104.24 107.96 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.121 -0.987 . . . . 0.0 109.983 179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.3 p -123.97 143.33 42.0 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.221 -0.925 . . . . 0.0 110.027 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.12 146.91 47.42 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.228 1.12 . . . . 0.0 110.331 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -102.53 158.6 31.44 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.288 -0.883 . . . . 0.0 110.241 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.93 70.71 3.56 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.425 1.224 . . . . 0.0 110.379 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -151.38 -58.61 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.24 -0.913 . . . . 0.0 110.428 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -115.22 156.59 25.08 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.209 -0.932 . . . . 0.0 110.165 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -101.48 -48.96 4.17 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.198 -0.939 . . . . 0.0 110.198 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.5 t -60.83 -40.41 92.67 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.219 -0.926 . . . . 0.0 109.981 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -136.35 -155.67 7.2 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.06 49.66 1.32 Allowed Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -117.0 131.63 56.91 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.221 -1.164 . . . . 0.0 110.127 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 tpt -117.31 151.66 36.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.096 -1.002 . . . . 0.0 110.423 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.8 pttt -131.3 141.93 50.03 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.271 -0.893 . . . . 0.0 110.163 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 80.3 mt-10 -120.08 164.58 15.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.0 109.757 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.418 ' CZ3' ' HB2' ' A' ' 9' ' ' ASP . 18.3 m95 -113.9 128.25 56.32 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.065 -1.022 . . . . 0.0 110.735 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.506 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 7.0 p90 -151.94 173.42 14.85 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.492 177.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.438 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 47.9 m80 -80.91 176.71 9.58 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.579 -0.701 . . . . 0.0 112.555 -176.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.434 HG21 ' NE2' ' A' ' 93' ' ' HIS . 21.1 mt -88.73 -53.95 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -54.72 -36.53 64.84 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.053 -1.029 . . . . 0.0 109.583 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 7.2 m -63.02 -51.68 65.86 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.313 -0.867 . . . . 0.0 109.15 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 7.5 tpt -69.03 -42.35 76.49 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.736 -0.786 . . . . 0.0 109.459 179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.428 ' CE2' HG22 ' A' ' 53' ' ' ILE . 12.8 m-85 -67.46 -30.57 70.32 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.981 179.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.94 -40.79 62.82 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.859 -1.15 . . . . 0.0 109.059 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -58.66 -39.31 80.26 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.369 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.7 mp -53.59 -41.87 67.05 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.158 -0.964 . . . . 0.0 109.263 178.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.5 -36.08 75.37 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.257 -0.902 . . . . 0.0 109.5 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.18 33.2 4.41 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.229 -0.92 . . . . 0.0 110.345 179.276 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -101.11 169.37 8.98 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.981 -1.075 . . . . 0.0 110.499 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.414 ' O ' ' OG1' ' A' ' 67' ' ' THR . 4.9 ttt-85 -62.26 158.31 17.49 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.225 -0.922 . . . . 0.0 110.324 -179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.77 -31.59 72.33 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.222 -0.924 . . . . 0.0 111.109 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.4 p -95.98 53.18 1.36 Allowed 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.849 -1.157 . . . . 0.0 110.393 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' A' ' 64' ' ' ARG . 1.1 m -116.97 163.29 16.44 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.097 -1.002 . . . . 0.0 110.067 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -94.8 145.41 24.9 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.151 -0.968 . . . . 0.0 109.712 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.92 161.68 29.3 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.236 -0.915 . . . . 0.0 110.816 -179.391 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.7 mt -89.52 124.0 42.01 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.255 -0.903 . . . . 0.0 109.877 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -116.36 148.25 40.8 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.263 -0.898 . . . . 0.0 110.188 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.14 177.34 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.079 -1.013 . . . . 0.0 110.683 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 61.5 tp -127.85 87.81 2.67 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.207 -0.933 . . . . 0.0 110.368 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -172.38 -51.35 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.199 -0.938 . . . . 0.0 110.84 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.87 -35.65 33.86 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 121.027 -1.046 . . . . 0.0 110.603 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.15 150.89 44.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.131 -0.981 . . . . 0.0 109.659 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -101.96 123.51 45.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.18 -0.95 . . . . 0.0 110.174 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 135.78 -36.86 1.97 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.47 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 43.0 p-90 -56.37 -37.37 69.97 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.939 -1.33 . . . . 0.0 110.685 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.47 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 2.9 tm-20 -71.87 -37.41 70.21 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.7 -29.14 69.07 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.184 -0.947 . . . . 0.0 111.037 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.421 HD11 ' CD2' ' A' ' 10' ' ' TYR . 85.0 mt -81.39 -173.77 4.55 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.851 -1.155 . . . . 0.0 110.262 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.54 162.36 12.96 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.204 -0.935 . . . . 0.0 110.469 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -86.6 -41.1 14.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.273 -0.892 . . . . 0.0 110.137 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -60.83 -47.62 85.53 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.267 -0.895 . . . . 0.0 109.435 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.426 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 17.6 mt-10 -60.61 -39.05 86.76 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.356 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 6.1 ttpt -56.17 -40.09 73.35 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.788 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.412 ' O ' ' OG1' ' A' ' 91' ' ' THR . 9.2 mt-10 -56.93 -36.07 69.79 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.218 179.471 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.58 -36.14 75.65 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.002 -1.061 . . . . 0.0 110.424 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 53.4 mt -65.26 -40.08 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.03 -1.044 . . . . 0.0 109.565 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.412 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 0.1 OUTLIER -60.57 -44.37 96.26 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.026 -1.046 . . . . 0.0 109.081 179.458 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -64.82 -39.63 93.89 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.434 ' NE2' HG21 ' A' ' 53' ' ' ILE . 16.8 t60 -57.08 -48.0 79.65 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.23 -0.919 . . . . 0.0 109.742 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.405 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 11.6 mt -65.09 -38.49 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.281 -0.967 . . . . 0.0 109.132 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.12 84.79 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.189 -0.944 . . . . 0.0 109.666 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.05 -37.38 82.42 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.236 -0.915 . . . . 0.0 110.002 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.6 tp -81.42 -38.27 26.76 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.061 -1.024 . . . . 0.0 110.112 179.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 30.4 t -74.61 -38.25 62.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.32 165.11 12.23 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.136 -0.977 . . . . 0.0 110.03 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -123.47 174.53 7.32 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.129 -0.982 . . . . 0.0 110.315 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -132.8 -165.15 1.56 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.283 -0.885 . . . . 0.0 110.177 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.16 166.17 12.33 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.183 -0.948 . . . . 0.0 110.173 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -77.54 138.3 21.48 Favored Glycine 0 N--CA 1.492 2.428 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 7.8 t -141.19 146.89 44.9 Favored Pre-proline 0 N--CA 1.495 1.786 0 O-C-N 121.267 -1.137 . . . . 0.0 110.296 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.99 83.96 1.36 Allowed 'Trans proline' 0 C--N 1.318 -1.07 0 O-C-N 123.314 1.165 . . . . 0.0 110.442 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.9 tttt 52.7 86.37 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.076 -1.015 . . . . 0.0 110.805 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -134.1 46.74 2.48 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.189 -0.944 . . . . 0.0 110.17 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -121.68 92.08 3.66 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.136 -0.977 . . . . 0.0 110.28 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.32 162.74 17.42 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.15 -0.969 . . . . 0.0 110.179 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.64 147.27 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.279 -0.888 . . . . 0.0 110.21 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.9 t -117.84 143.06 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.199 -0.938 . . . . 0.0 109.933 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -117.17 123.47 46.78 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.22 -0.925 . . . . 0.0 110.224 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.73 141.36 48.69 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.156 -0.965 . . . . 0.0 110.13 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -116.0 102.82 9.99 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.233 -0.917 . . . . 0.0 110.15 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.68 120.01 34.48 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.216 -0.928 . . . . 0.0 110.177 179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 29.6 m -125.98 124.18 40.16 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.212 -0.93 . . . . 0.0 110.19 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 12.1 p . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.224 -179.984 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 ttt . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -121.24 -173.76 2.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.126 -0.984 . . . . 0.0 110.202 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -147.27 84.13 1.57 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.224 -0.922 . . . . 0.0 110.437 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -125.84 141.83 51.8 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.157 -0.964 . . . . 0.0 110.227 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.55 139.51 52.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.16 -0.962 . . . . 0.0 110.143 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.409 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 1.9 m-85 -119.74 154.66 33.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.182 -0.948 . . . . 0.0 110.326 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -143.76 134.29 24.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.318 -0.864 . . . . 0.0 110.298 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 47.7 t -102.5 105.76 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.223 -0.923 . . . . 0.0 109.671 179.64 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -118.02 159.45 23.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.14 -0.975 . . . . 0.0 110.874 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.424 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -106.73 149.1 27.65 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.545 -0.722 . . . . 0.0 109.637 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.43 123.74 27.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.173 -0.954 . . . . 0.0 109.953 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -149.65 39.36 0.79 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.183 -0.948 . . . . 0.0 110.588 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -136.38 -66.03 0.55 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.215 -0.928 . . . . 0.0 110.156 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.69 -137.67 2.52 Favored Glycine 0 N--CA 1.497 2.745 0 N-CA-C 110.064 -1.215 . . . . 0.0 110.064 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 70.3 p -122.78 116.22 23.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.231 -1.158 . . . . 0.0 110.038 179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 134.67 54.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.131 -0.981 . . . . 0.0 110.653 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.27 123.12 31.55 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 108.527 -1.829 . . . . 0.0 108.527 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.473 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 26.3 p -64.59 129.09 38.5 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.29 -1.123 . . . . 0.0 110.914 -178.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.429 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 35.5 mmtt -75.45 156.02 35.7 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.578 -0.701 . . . . 0.0 109.251 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 65.76 15.82 10.22 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.85 -1.156 . . . . 0.0 111.704 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.8 p -174.91 151.27 1.35 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.557 -1.339 . . . . 0.0 110.752 178.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -87.1 90.73 8.46 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.053 -1.029 . . . . 0.0 111.647 -177.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 0.4 OUTLIER -167.62 -174.0 2.35 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.332 -0.855 . . . . 0.0 110.412 178.947 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -126.08 154.03 43.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.989 -1.07 . . . . 0.0 110.036 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.4 mt -109.86 103.09 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.404 -0.81 . . . . 0.0 109.912 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 22.9 m -110.98 162.98 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.259 -0.901 . . . . 0.0 110.397 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -49.6 137.27 15.73 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.415 -0.803 . . . . 0.0 111.033 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.36 50.74 Favored Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.184 -1.007 . . . . 0.0 111.499 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.1 p -126.86 137.36 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.73 1.765 . . . . 0.0 110.786 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.417 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 42.3 t -93.49 138.98 31.25 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.237 -0.914 . . . . 0.0 109.774 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.437 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 4.1 ptt180 -135.09 147.78 49.64 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.258 -0.901 . . . . 0.0 110.348 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.408 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 15.1 mt -106.33 123.83 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.313 -0.867 . . . . 0.0 109.523 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.24 137.22 13.32 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 37.4 ttpt -107.26 124.2 49.42 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.233 -1.157 . . . . 0.0 109.379 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.4 t -99.98 114.45 38.48 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.069 -1.019 . . . . 0.0 110.321 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.2 p -121.82 138.18 28.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.292 -0.88 . . . . 0.0 110.345 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.2 151.28 34.1 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 O-C-N 123.003 1.002 . . . . 0.0 110.458 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -102.84 162.75 19.2 Favored Pre-proline 0 N--CA 1.5 2.025 0 O-C-N 121.298 -0.876 . . . . 0.0 110.088 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.08 -43.12 1.24 Allowed 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.348 1.183 . . . . 0.0 110.334 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -126.1 98.93 5.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.235 -0.915 . . . . 0.0 110.038 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.414 ' OG ' ' HA3' ' A' ' 45' ' ' GLY . 9.5 p -140.22 125.25 18.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.227 -0.92 . . . . 0.0 110.205 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -102.55 -54.19 2.72 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.204 -0.935 . . . . 0.0 110.135 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.22 -40.9 12.54 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.224 -0.922 . . . . 0.0 110.107 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -80.29 -108.83 0.28 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . 0.414 ' HA3' ' OG ' ' A' ' 41' ' ' SER . . . 123.68 -64.83 0.53 Allowed Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.76 143.83 44.44 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.255 -1.144 . . . . 0.0 109.986 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 mmt -116.82 139.08 51.02 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.172 -0.955 . . . . 0.0 110.285 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.412 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 6.1 ttmm -129.37 130.64 46.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.276 -0.89 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -114.68 138.74 50.34 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.204 -0.935 . . . . 0.0 109.82 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 11.5 m95 -93.98 112.76 24.63 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.191 -0.943 . . . . 0.0 110.852 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.432 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -123.54 170.93 9.92 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.47 177.064 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.473 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.0 m80 -88.97 -173.88 4.25 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.442 -0.786 . . . . 0.0 110.338 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 34.7 mm -83.22 -54.61 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 tttp -60.07 -37.5 80.05 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.292 -0.88 . . . . 0.0 109.398 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 19.4 m -60.75 -51.22 70.28 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.208 -0.932 . . . . 0.0 109.14 179.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 11.3 tpt -69.21 -45.43 69.87 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.365 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.423 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 11.2 m-85 -63.21 -29.88 71.13 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.833 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -62.84 -41.55 99.39 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.885 -1.134 . . . . 0.0 109.122 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -40.88 92.11 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.226 -0.921 . . . . 0.0 108.927 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -55.78 -41.71 74.49 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.139 -0.976 . . . . 0.0 109.237 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.26 -35.45 71.76 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.314 -0.866 . . . . 0.0 109.581 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.7 mmt85 -105.97 31.16 5.27 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.196 -0.94 . . . . 0.0 110.544 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.94 168.5 9.43 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.987 -1.071 . . . . 0.0 110.086 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -62.9 153.83 32.16 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.217 -0.927 . . . . 0.0 110.09 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.88 -34.46 19.42 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.22 -0.925 . . . . 0.0 110.65 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.38 -35.78 40.33 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.96 -1.087 . . . . 0.0 110.91 -179.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.8 m -110.98 132.68 54.0 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.112 -0.993 . . . . 0.0 110.302 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -117.51 144.87 44.64 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.18 -0.95 . . . . 0.0 110.188 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.87 137.53 51.54 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.192 -0.943 . . . . 0.0 110.284 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.408 HG22 HD11 ' A' ' 70' ' ' ILE . 78.3 mt 54.21 99.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.08 -1.013 . . . . 0.0 110.782 -179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -107.43 139.18 42.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.188 -0.945 . . . . 0.0 109.403 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.62 -163.99 0.12 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.964 -1.085 . . . . 0.0 110.053 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.42 HD21 ' OG1' ' A' ' 91' ' ' THR . 56.4 tp -116.08 70.84 0.76 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.034 -1.041 . . . . 0.0 110.473 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.68 -163.7 0.34 Allowed 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.229 -0.92 . . . . 0.0 110.314 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 54.44 37.45 27.76 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.996 -1.065 . . . . 0.0 110.259 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -145.22 151.53 38.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.197 -0.94 . . . . 0.0 109.74 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -94.49 97.18 9.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.123 -0.985 . . . . 0.0 109.99 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.12 -36.56 0.95 Allowed Glycine 0 N--CA 1.495 2.627 0 C-N-CA 119.72 -1.229 . . . . 0.0 110.752 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 52.8 p-90 -56.01 -34.78 66.14 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.921 1.36 . . . . 0.0 110.616 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.41 -43.81 96.42 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.052 -1.03 . . . . 0.0 109.439 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -60.45 -39.75 88.68 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.14 -0.975 . . . . 0.0 109.75 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.5 mp -49.38 173.56 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.907 0 O-C-N 121.219 -0.926 . . . . 0.0 110.643 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -101.23 161.0 13.93 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.069 -1.019 . . . . 0.0 110.383 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -55.59 -36.18 66.61 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.181 -0.949 . . . . 0.0 110.967 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -70.41 -43.48 69.9 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.063 -1.023 . . . . 0.0 109.452 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.424 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 22.2 mt-10 -70.64 -39.35 73.71 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.839 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 26.0 tttt -61.81 -37.43 84.38 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.286 -0.884 . . . . 0.0 109.853 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -65.91 -40.25 91.32 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.149 -0.969 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.33 79.72 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.241 -0.912 . . . . 0.0 110.538 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 98.5 mt -68.19 -36.99 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 O-C-N 121.113 -0.992 . . . . 0.0 109.434 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.42 ' OG1' HD21 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -61.43 -38.92 88.89 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.886 -1.134 . . . . 0.0 109.451 179.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -57.39 -37.96 73.51 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.164 -0.96 . . . . 0.0 109.874 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.459 ' CE1' ' CG2' ' A' ' 53' ' ' ILE . 2.7 m-70 -55.01 -47.8 74.2 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.116 -0.99 . . . . 0.0 110.066 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mp -66.0 -38.89 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.238 -0.914 . . . . 0.0 109.197 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.26 79.21 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.186 -0.946 . . . . 0.0 109.696 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.8 -36.97 85.01 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.168 -0.958 . . . . 0.0 109.903 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.2 tp -82.31 -30.9 30.24 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.066 -1.021 . . . . 0.0 110.646 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.8 t -101.26 55.78 0.84 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.869 -1.145 . . . . 0.0 110.263 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 p -135.57 77.14 1.65 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.015 . . . . 0.0 110.247 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 41.8 tttt -143.58 -59.19 0.41 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.183 -0.948 . . . . 0.0 110.34 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -145.09 40.11 1.23 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.148 -0.97 . . . . 0.0 110.297 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.42 -167.45 2.34 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.145 -0.972 . . . . 0.0 110.215 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.444 ' O ' ' OG1' ' A' ' 104' ' ' THR . . . 115.53 91.76 1.76 Allowed Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' THR . . . . . 0.444 ' OG1' ' O ' ' A' ' 103' ' ' GLY . 82.6 p 46.61 89.75 0.09 OUTLIER Pre-proline 0 N--CA 1.504 2.246 0 O-C-N 121.324 -1.103 . . . . 0.0 111.436 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -73.19 -40.38 1.72 Allowed 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.471 1.248 . . . . 0.0 110.417 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -132.0 -179.38 5.37 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.208 -0.933 . . . . 0.0 110.368 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 23.7 tttm -141.68 170.43 15.73 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.247 -0.908 . . . . 0.0 110.138 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -141.6 84.41 1.9 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.117 -0.99 . . . . 0.0 110.284 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.47 143.92 45.55 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.282 -0.886 . . . . 0.0 110.22 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 9.0 p -130.52 146.35 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.213 -0.929 . . . . 0.0 110.206 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -138.21 144.68 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.133 -0.979 . . . . 0.0 110.287 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -118.16 104.93 11.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.191 -0.943 . . . . 0.0 110.227 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.11 141.34 48.39 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.137 -0.977 . . . . 0.0 110.229 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -115.92 101.32 8.67 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.146 -0.971 . . . . 0.0 110.317 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.9 tp -117.65 150.21 39.42 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.205 -0.935 . . . . 0.0 110.072 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.4 p -134.94 109.19 8.31 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.179 -0.951 . . . . 0.0 110.275 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.194 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -127.27 49.03 2.14 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.306 -0.871 . . . . 0.0 110.152 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -121.54 161.57 22.1 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.14 -0.975 . . . . 0.0 110.283 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -117.33 139.18 51.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.205 -0.934 . . . . 0.0 110.173 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.76 126.18 51.98 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.233 -0.917 . . . . 0.0 110.177 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.45 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 1.5 m-85 -116.18 143.95 44.82 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.171 -0.956 . . . . 0.0 110.059 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.5 p -141.03 138.32 33.58 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.237 -0.914 . . . . 0.0 109.877 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.4 ' CG1' ' CD2' ' A' ' 76' ' ' LEU . 21.7 m -104.53 140.5 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.093 -1.004 . . . . 0.0 110.222 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -142.28 156.05 45.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.245 -0.909 . . . . 0.0 110.335 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -107.35 154.07 21.83 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.359 -0.838 . . . . 0.0 109.792 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -82.33 142.27 32.18 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.243 -0.911 . . . . 0.0 110.058 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -143.51 -59.86 0.41 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.292 -0.88 . . . . 0.0 110.163 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.62 84.57 2.25 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.251 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.34 174.82 14.51 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 55.3 p -140.68 139.18 34.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.184 -1.186 . . . . 0.0 110.204 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -123.42 150.77 43.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.214 -0.929 . . . . 0.0 110.677 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.08 120.13 5.22 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.6 t -64.71 122.52 17.07 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.262 -1.14 . . . . 0.0 109.732 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.83 148.05 44.52 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.057 -1.027 . . . . 0.0 108.669 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp 53.0 64.93 1.67 Allowed 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.906 -1.121 . . . . 0.0 108.949 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -172.94 -43.65 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.221 -0.924 . . . . 0.0 112.555 -177.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tttm 70.06 44.85 0.75 Allowed 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.884 -1.135 . . . . 0.0 108.202 -177.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.72 -168.38 2.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.556 -0.715 . . . . 0.0 109.49 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -137.22 157.5 46.52 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.984 -1.073 . . . . 0.0 110.42 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 69.5 mt -110.95 110.28 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.402 -0.811 . . . . 0.0 109.826 179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.4 m -110.11 169.39 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 O-C-N 121.187 -0.946 . . . . 0.0 110.614 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.8 tttt -46.6 138.61 5.8 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 121.56 -0.712 . . . . 0.0 111.136 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 107.57 -23.16 27.02 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.968 -1.11 . . . . 0.0 110.533 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.8 p -113.52 137.59 46.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-N 119.151 1.475 . . . . 0.0 110.318 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.8 t -91.17 142.43 27.75 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.045 -1.035 . . . . 0.0 110.199 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.431 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 1.1 ptt180 -128.16 153.3 47.03 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.143 -0.973 . . . . 0.0 110.533 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 11.4 mt -111.95 137.26 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.344 -0.847 . . . . 0.0 110.414 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.414 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.09 129.2 9.58 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 108.348 -1.901 . . . . 0.0 108.348 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.45 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 33.6 ttpt -110.15 116.96 32.47 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.069 -1.253 . . . . 0.0 110.395 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.6 t -109.24 109.4 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.222 -0.924 . . . . 0.0 110.017 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.3 t -120.53 112.57 34.03 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.215 -0.928 . . . . 0.0 109.961 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.3 133.75 19.82 Favored 'Trans proline' 0 C--N 1.32 -0.941 0 O-C-N 123.119 1.063 . . . . 0.0 110.393 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -103.48 118.84 56.67 Favored Pre-proline 0 N--CA 1.5 2.049 0 O-C-N 121.203 -0.935 . . . . 0.0 110.028 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.6 71.08 3.27 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 O-C-N 123.186 1.098 . . . . 0.0 110.396 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -150.49 -58.59 0.18 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.129 -0.982 . . . . 0.0 110.468 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.67 157.11 22.59 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.161 -0.962 . . . . 0.0 110.229 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -96.02 -39.22 9.86 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.248 -0.908 . . . . 0.0 110.461 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.7 m -57.23 -39.69 76.03 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.048 -1.032 . . . . 0.0 110.167 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -74.15 -60.85 3.42 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.22 -99.48 0.8 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -133.33 147.41 51.84 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.167 -1.196 . . . . 0.0 110.331 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.7 mtt -115.27 143.58 45.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.167 -0.958 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -118.6 123.88 46.08 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.225 -0.922 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -116.66 137.21 52.36 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.181 -0.949 . . . . 0.0 109.897 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 26.7 m95 -92.84 134.48 35.04 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.219 -0.925 . . . . 0.0 109.998 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -121.71 176.01 5.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.255 -0.903 . . . . 0.0 110.739 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.6 m80 -96.69 -172.36 2.47 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 178.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.496 HG23 ' NE2' ' A' ' 93' ' ' HIS . 39.8 mm -84.74 -37.14 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.998 -1.064 . . . . 0.0 109.275 178.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.45 -27.26 20.49 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.74 -1.225 . . . . 0.0 111.213 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 83.3 m -70.46 -46.49 63.7 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.819 -1.176 . . . . 0.0 110.435 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.7 tpt -68.8 -38.52 80.0 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.323 -179.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.429 ' CE1' HG13 ' A' ' 94' ' ' ILE . 9.3 m-85 -75.05 -31.43 61.3 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.803 -1.159 . . . . 0.0 109.578 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -62.51 -36.21 81.82 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.026 -1.047 . . . . 0.0 109.524 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -60.24 -40.16 89.28 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.093 -1.005 . . . . 0.0 109.758 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -60.96 -42.33 98.08 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.975 . . . . 0.0 109.154 179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -56.08 -33.68 65.27 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.205 -0.935 . . . . 0.0 109.674 178.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 33.4 mtm-85 -102.63 29.59 5.21 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.279 -0.888 . . . . 0.0 110.449 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.14 169.41 8.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.905 -1.122 . . . . 0.0 109.902 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.96 146.77 25.36 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.184 -0.948 . . . . 0.0 110.177 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.14 -34.1 71.67 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.187 -0.946 . . . . 0.0 110.7 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.64 -35.72 31.95 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 121.028 -1.045 . . . . 0.0 111.075 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 29.7 m -113.57 121.57 44.62 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.069 -1.019 . . . . 0.0 110.285 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -118.15 144.52 45.63 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.192 -0.942 . . . . 0.0 110.176 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.3 mtmt -124.58 139.4 53.91 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.129 -0.982 . . . . 0.0 110.402 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.2 mt 54.77 101.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.2 -0.937 . . . . 0.0 110.821 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -110.92 143.32 41.73 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.068 -1.02 . . . . 0.0 109.892 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.58 -170.75 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.039 -1.038 . . . . 0.0 110.477 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 2.8 tp -111.37 43.4 1.5 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.146 -0.971 . . . . 0.0 110.105 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.9 -168.9 3.24 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.141 -0.974 . . . . 0.0 110.051 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 55.42 38.11 29.83 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.905 -1.122 . . . . 0.0 109.935 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.4 ' CD2' ' CG1' ' A' ' 8' ' ' VAL . 1.5 tp -144.65 150.44 37.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.348 -0.845 . . . . 0.0 109.48 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -93.78 104.45 16.53 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.061 -1.024 . . . . 0.0 110.464 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.02 -45.26 0.68 Allowed Glycine 0 N--CA 1.494 2.514 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.762 179.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 34.0 p-90 -58.72 -35.51 72.79 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.004 -1.292 . . . . 0.0 110.614 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -56.17 -34.4 66.14 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.921 -1.112 . . . . 0.0 110.699 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -83.58 -34.87 25.08 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.953 -1.092 . . . . 0.0 110.722 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.77 175.1 0.01 OUTLIER 'General case' 0 N--CA 1.518 2.93 0 O-C-N 121.067 -1.02 . . . . 0.0 110.941 -179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.76 161.61 13.53 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.312 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.59 -45.3 89.41 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.976 . . . . 0.0 110.41 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -61.52 -51.75 67.32 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.533 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.65 -39.33 94.09 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.111 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp -59.96 -38.75 83.39 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.305 -0.872 . . . . 0.0 109.709 179.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -60.32 -39.35 86.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.15 -0.969 . . . . 0.0 109.861 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.84 -40.95 90.25 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.14 -0.975 . . . . 0.0 110.1 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 10.4 mt -62.28 -40.19 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 O-C-N 121.205 -0.934 . . . . 0.0 109.524 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.9 m -58.15 -39.62 79.25 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.04 -1.037 . . . . 0.0 109.921 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.8 -39.27 80.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.227 -0.92 . . . . 0.0 109.627 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.496 ' NE2' HG23 ' A' ' 53' ' ' ILE . 7.3 m-70 -60.01 -52.04 67.08 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.253 -0.904 . . . . 0.0 109.778 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.429 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.6 mt -62.68 -39.08 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.383 -0.927 . . . . 0.0 109.444 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.72 94.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.187 -0.946 . . . . 0.0 109.47 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.7 -39.7 66.78 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.229 -0.919 . . . . 0.0 109.11 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 21.6 tp -68.5 -32.58 72.66 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.267 -0.896 . . . . 0.0 110.363 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 16.3 t -92.81 -40.63 10.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.925 -1.109 . . . . 0.0 110.177 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t -128.23 166.56 18.33 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.143 -0.973 . . . . 0.0 110.147 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 35.1 tttm -138.88 110.2 6.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.207 -0.933 . . . . 0.0 110.306 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.41 161.34 20.68 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.193 -0.942 . . . . 0.0 110.233 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.46 144.65 40.19 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.238 -0.914 . . . . 0.0 110.28 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -128.05 -159.17 9.96 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.5 p -125.17 149.2 63.04 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.173 -1.193 . . . . 0.0 110.252 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.72 -43.21 0.93 Allowed 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.42 1.221 . . . . 0.0 110.415 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt -140.21 170.76 15.22 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.17 -0.956 . . . . 0.0 110.232 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.52 -63.67 1.4 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.251 -0.906 . . . . 0.0 110.271 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -117.19 73.45 0.87 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.199 -0.938 . . . . 0.0 110.204 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -119.6 167.49 11.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.179 -0.951 . . . . 0.0 110.123 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.6 t -114.21 132.78 62.28 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.217 -0.927 . . . . 0.0 109.991 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.4 p -136.01 143.29 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.196 -0.94 . . . . 0.0 110.151 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -118.73 126.96 53.06 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.261 -0.9 . . . . 0.0 110.244 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.62 101.5 8.41 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.158 -0.964 . . . . 0.0 110.137 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -117.19 137.23 52.48 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.169 -0.957 . . . . 0.0 110.248 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -119.91 153.5 35.79 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.217 -0.927 . . . . 0.0 110.17 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.33 136.05 53.5 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.206 -0.934 . . . . 0.0 110.215 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.304 -179.986 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 ttt . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.53 92.11 2.33 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.16 -0.962 . . . . 0.0 110.274 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -127.19 126.93 43.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.212 -0.93 . . . . 0.0 110.212 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.89 164.04 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.254 -0.904 . . . . 0.0 110.491 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -124.01 129.98 51.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.147 -0.971 . . . . 0.0 110.167 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.416 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.4 m-85 -124.02 137.44 54.59 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.158 -0.964 . . . . 0.0 110.086 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.2 t -126.77 147.87 49.96 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 109.628 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.404 ' CG1' ' CD2' ' A' ' 76' ' ' LEU . 27.2 m -116.18 139.63 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 121.057 -1.027 . . . . 0.0 110.604 179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -147.5 162.73 38.47 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.24 -0.913 . . . . 0.0 110.399 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.428 ' OH ' ' HB3' ' A' ' 86' ' ' GLU . 0.6 OUTLIER -110.29 141.55 43.12 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.368 -0.832 . . . . 0.0 109.814 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -63.93 134.06 54.4 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.744 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -140.62 -65.68 0.45 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.209 -0.932 . . . . 0.0 110.465 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -121.97 85.33 2.39 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.176 -0.953 . . . . 0.0 110.228 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 126.92 159.36 10.16 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -132.48 149.64 52.3 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.212 -1.169 . . . . 0.0 110.086 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.06 145.85 50.58 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.168 -0.958 . . . . 0.0 110.557 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.43 118.63 7.97 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.9 t -63.85 123.28 18.52 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.191 -1.182 . . . . 0.0 109.695 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.61 147.86 44.33 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.08 -1.013 . . . . 0.0 108.664 179.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt 53.09 64.66 1.78 Allowed 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.979 -1.076 . . . . 0.0 108.815 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -173.04 -43.58 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.249 -0.907 . . . . 0.0 112.583 -177.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt 69.06 44.15 1.04 Allowed 'General case' 0 N--CA 1.505 2.295 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -177.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 -168.71 2.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.564 -0.71 . . . . 0.0 109.437 -179.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -140.1 158.67 43.69 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.017 -1.052 . . . . 0.0 110.193 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 50.8 mt -102.89 118.12 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.505 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.3 t -107.76 160.25 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.162 -0.961 . . . . 0.0 110.352 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -48.49 121.7 4.74 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 121.444 -0.785 . . . . 0.0 111.15 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.68 -25.93 5.24 Favored Glycine 0 N--CA 1.493 2.448 0 C-N-CA 119.999 -1.096 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 6.6 m -104.38 137.61 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 CA-C-N 119.148 1.474 . . . . 0.0 110.488 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 1.3 t -81.06 134.99 35.76 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.192 -0.942 . . . . 0.0 109.647 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.422 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 12.0 ptt-85 -122.43 149.03 44.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.201 -0.937 . . . . 0.0 110.402 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.426 HG23 HD11 ' A' ' 32' ' ' ILE . 13.1 mt -108.35 139.87 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.315 -0.865 . . . . 0.0 110.603 -179.42 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.03 122.38 6.9 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 41.0 tttt -105.97 120.07 40.83 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.101 -1.235 . . . . 0.0 110.082 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.402 ' CG1' ' CB ' ' A' ' 46' ' ' ASP . 62.1 t -103.5 107.17 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.25 -0.906 . . . . 0.0 110.22 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.7 t -122.31 138.31 28.89 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 109.615 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.92 131.89 16.24 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.262 1.138 . . . . 0.0 110.22 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 -103.19 154.31 37.76 Favored Pre-proline 0 N--CA 1.499 1.999 0 O-C-N 121.102 -0.999 . . . . 0.0 110.166 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -72.45 -40.25 2.32 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.43 1.226 . . . . 0.0 110.306 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -115.13 107.31 15.15 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.224 -0.922 . . . . 0.0 110.07 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.53 157.0 42.41 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.189 -0.945 . . . . 0.0 110.364 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -95.98 -39.34 9.82 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.241 -0.912 . . . . 0.0 110.401 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 t -87.76 -40.06 14.4 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.006 -1.059 . . . . 0.0 110.005 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 106.28 112.56 3.7 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 140.85 -148.5 20.14 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.402 ' CB ' ' CG1' ' A' ' 35' ' ' VAL . 0.9 OUTLIER -116.74 158.09 24.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.166 -1.196 . . . . 0.0 110.245 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttt -101.72 144.16 30.76 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.363 -0.836 . . . . 0.0 110.119 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.425 ' HE3' ' CZ2' ' A' ' 50' ' ' TRP . 26.9 ttpt -116.53 123.01 46.37 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.327 -0.858 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -115.26 140.36 49.17 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.346 -0.846 . . . . 0.0 109.712 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.452 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 57.0 m95 -97.83 128.14 44.26 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.137 -0.977 . . . . 0.0 110.167 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -115.81 174.64 5.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.344 -0.847 . . . . 0.0 110.855 -179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 8.8 m80 -91.28 -171.43 2.95 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.465 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 46.6 mm -83.49 -39.9 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.879 -1.138 . . . . 0.0 109.722 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -85.06 -32.26 22.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 120.83 -1.169 . . . . 0.0 111.058 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 71.2 m -62.68 -52.89 61.51 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.994 -1.066 . . . . 0.0 110.4 -179.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -40.39 88.02 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.012 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.502 ' CG ' ' NE2' ' A' ' 93' ' ' HIS . 9.6 m-85 -70.97 -30.43 66.7 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 119.08 -1.048 . . . . 0.0 109.634 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -61.35 -36.86 81.35 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.598 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.14 88.58 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.024 -1.048 . . . . 0.0 109.804 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.05 -44.42 95.92 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.429 -0.909 . . . . 0.0 108.969 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.38 -33.62 68.01 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.218 -0.926 . . . . 0.0 109.695 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.65 29.33 5.82 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.277 -0.889 . . . . 0.0 110.576 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -116.87 166.89 11.63 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.888 -1.133 . . . . 0.0 110.042 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -64.78 155.98 32.1 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.209 -0.932 . . . . 0.0 109.904 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.79 -33.36 27.3 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.216 -0.927 . . . . 0.0 110.764 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.6 p -50.26 -35.52 27.35 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 120.987 -1.07 . . . . 0.0 110.947 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 77.2 p -110.06 124.47 51.53 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.096 -1.002 . . . . 0.0 109.888 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -116.27 144.58 44.04 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.254 -0.904 . . . . 0.0 110.369 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.2 mtpp -122.51 146.82 47.05 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.264 -0.898 . . . . 0.0 110.103 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.461 HG22 HD11 ' A' ' 70' ' ' ILE . 77.4 mt 54.54 99.34 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.213 -0.929 . . . . 0.0 110.704 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -112.7 135.25 53.66 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 0.0 109.978 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.0 -173.52 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.039 -1.038 . . . . 0.0 110.547 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 49.8 tp -113.71 83.26 1.82 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.162 -0.961 . . . . 0.0 110.22 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.0 -51.62 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.161 -0.962 . . . . 0.0 111.056 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -49.38 -36.32 21.43 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.113 -0.992 . . . . 0.0 110.796 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.404 ' CD2' ' CG1' ' A' ' 8' ' ' VAL . 6.3 mp -72.74 150.43 42.87 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.189 -0.944 . . . . 0.0 109.367 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -97.77 136.74 37.68 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.249 -0.907 . . . . 0.0 111.251 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.53 -41.63 1.52 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.46 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 52.9 p-90 -53.96 -35.65 62.01 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.993 -1.298 . . . . 0.0 110.868 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.46 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 15.8 tt0 -68.11 -28.93 67.76 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.111 -0.993 . . . . 0.0 111.035 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -96.38 -34.52 11.51 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 120.826 -1.171 . . . . 0.0 111.251 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.4 HD11 ' CD2' ' A' ' 10' ' ' TYR . 74.4 mt -59.25 -175.3 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.865 -1.147 . . . . 0.0 110.151 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.33 161.63 11.21 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.154 -0.966 . . . . 0.0 110.26 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.2 -45.43 11.33 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.217 -0.927 . . . . 0.0 109.925 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -62.6 -42.45 99.58 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.315 -0.866 . . . . 0.0 109.396 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.428 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 1.1 mp0 -61.57 -40.28 94.16 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.338 -0.851 . . . . 0.0 109.514 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.2 ttpt -57.66 -39.57 77.33 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.322 -0.861 . . . . 0.0 109.943 179.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -60.41 -42.23 95.53 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.206 -0.933 . . . . 0.0 109.637 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -59.81 -35.37 74.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.324 -0.86 . . . . 0.0 110.237 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 37.9 mm -60.33 -38.93 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.492 0 O-C-N 121.109 -0.994 . . . . 0.0 109.634 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 m -58.59 -42.53 88.29 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.02 -1.05 . . . . 0.0 109.795 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -63.35 -40.64 97.84 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.297 -0.877 . . . . 0.0 109.284 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.502 ' NE2' ' CG ' ' A' ' 57' ' ' PHE . 67.6 t60 -58.39 -41.8 85.7 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.192 -0.942 . . . . 0.0 109.59 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.441 ' CG1' ' CZ ' ' A' ' 57' ' ' PHE . 9.3 mt -69.75 -39.62 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.176 -0.952 . . . . 0.0 108.9 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.89 -38.05 84.32 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.211 -0.931 . . . . 0.0 109.728 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -63.62 -41.48 98.27 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.134 -0.978 . . . . 0.0 109.488 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.9 tp -60.7 -35.58 76.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.243 -0.911 . . . . 0.0 110.33 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.1 t -89.93 -39.29 13.1 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.05 -1.031 . . . . 0.0 110.178 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 41.8 t -114.51 106.53 14.38 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.183 -0.948 . . . . 0.0 110.099 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.8 tttp -116.35 135.64 53.69 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.167 -0.958 . . . . 0.0 110.27 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.66 77.6 1.78 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.183 -0.948 . . . . 0.0 110.131 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.44 124.56 15.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.168 -0.958 . . . . 0.0 110.3 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -137.5 46.05 1.03 Allowed Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.504 -1.439 . . . . 0.0 109.504 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 25.3 m -138.89 56.71 9.74 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.183 -1.187 . . . . 0.0 110.176 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.52 129.36 14.62 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.287 1.151 . . . . 0.0 110.338 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -144.42 139.1 28.18 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.203 -0.936 . . . . 0.0 110.299 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -135.81 -65.07 0.6 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.192 -0.943 . . . . 0.0 110.198 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -144.73 -58.82 0.36 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.179 -0.95 . . . . 0.0 110.47 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -134.29 110.11 9.28 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.168 -0.958 . . . . 0.0 110.204 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.7 t -118.29 100.12 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.241 -0.912 . . . . 0.0 109.889 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.1 t -138.11 143.1 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.269 -0.894 . . . . 0.0 110.0 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -117.15 138.88 51.37 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.091 -1.006 . . . . 0.0 110.231 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.26 127.82 54.09 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.21 -0.931 . . . . 0.0 110.234 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 20.1 mtmm -121.27 105.66 10.76 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.167 -0.958 . . . . 0.0 110.185 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.7 mt -120.33 103.67 9.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.206 -0.934 . . . . 0.0 110.206 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.0 p -136.7 118.6 15.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.228 -0.92 . . . . 0.0 110.125 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 117.944 -1.026 . . . . 0.0 110.141 -179.995 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 ttt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.38 -59.68 0.41 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.171 -0.955 . . . . 0.0 110.253 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -128.56 166.09 19.51 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.283 -0.886 . . . . 0.0 110.144 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -118.58 130.22 55.77 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 110.231 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -141.47 125.43 17.17 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.915 . . . . 0.0 110.288 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.443 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 0.9 OUTLIER -117.05 141.56 48.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.17 -0.956 . . . . 0.0 110.052 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 80.5 m -127.74 156.39 42.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 109.803 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 59.6 t -111.2 120.58 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.128 -0.982 . . . . 0.0 109.927 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -137.95 156.45 47.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.136 -0.978 . . . . 0.0 110.605 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -101.45 154.1 19.11 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.485 -0.76 . . . . 0.0 109.693 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.27 140.76 29.38 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.246 -0.909 . . . . 0.0 110.34 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 tttp -136.03 -58.11 0.76 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.279 -0.888 . . . . 0.0 110.456 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -134.34 99.14 4.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.075 . . . . 0.0 110.316 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.6 138.65 3.35 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 76.6 p -124.54 146.35 49.06 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.189 -1.183 . . . . 0.0 109.942 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -163.35 153.93 16.16 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.18 -0.95 . . . . 0.0 111.435 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.77 120.13 8.66 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.447 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 24.5 p -58.92 140.29 55.64 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.184 -1.186 . . . . 0.0 110.21 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 8.0 tptt -94.19 150.73 20.04 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.114 -0.991 . . . . 0.0 110.581 -178.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 13.2 mptt 51.6 48.39 22.97 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.447 ' HB3' ' SG ' ' A' ' 18' ' ' CYS 0.263 10.4 t -165.2 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.861 -0.524 . . . . 0.0 110.485 -175.481 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 21' ' ' CYS . 23.5 tttt 78.12 74.22 0.06 Allowed 'General case' 0 N--CA 1.526 3.342 0 O-C-N 120.947 -1.096 . . . . 0.0 112.492 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.404 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.4 tt0 -176.11 -172.88 0.53 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.165 -0.959 . . . . 0.0 110.604 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -120.3 146.16 46.38 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.112 -0.992 . . . . 0.0 109.142 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.9 mt -107.11 141.82 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.058 -1.026 . . . . 0.0 110.477 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.4 t -141.12 158.04 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.249 -0.907 . . . . 0.0 109.961 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.54 135.97 17.43 Favored 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.287 -0.883 . . . . 0.0 111.089 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.56 8.72 39.81 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.155 -1.021 . . . . 0.0 111.828 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.8 p -127.45 132.79 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-N 119.853 1.827 . . . . 0.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 20.2 t -73.19 143.3 47.25 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.22 -0.925 . . . . 0.0 108.855 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.422 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 11.9 ptt180 -145.47 155.38 43.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.123 -0.986 . . . . 0.0 111.475 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.8 mt -105.08 145.09 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.449 -0.782 . . . . 0.0 109.848 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.83 137.69 13.91 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 108.413 -1.875 . . . . 0.0 108.413 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.443 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 19.4 ttpt -117.94 123.75 46.55 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.903 -1.351 . . . . 0.0 110.42 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -96.44 113.09 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.229 -0.919 . . . . 0.0 110.115 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.9 t -120.49 119.13 30.6 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.267 -0.896 . . . . 0.0 109.916 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.35 145.66 38.73 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 O-C-N 123.132 1.07 . . . . 0.0 110.342 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -102.88 146.93 33.31 Favored Pre-proline 0 N--CA 1.5 2.039 0 O-C-N 121.149 -0.97 . . . . 0.0 110.151 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.62 70.25 4.2 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.328 1.173 . . . . 0.0 110.46 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -153.55 -58.88 0.13 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.09 -1.006 . . . . 0.0 110.499 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.3 t -121.26 144.6 48.53 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.245 -0.91 . . . . 0.0 110.157 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -99.39 -22.16 15.68 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.195 -0.94 . . . . 0.0 111.886 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 m -88.77 -40.6 13.09 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.615 -1.303 . . . . 0.0 110.074 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -130.0 66.76 0.57 Allowed Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -136.9 75.98 0.38 Allowed Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -144.22 136.61 26.66 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -1.207 . . . . 0.0 110.268 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ttt -117.04 142.95 46.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.275 -0.891 . . . . 0.0 110.34 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -125.25 120.74 32.09 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.278 -0.889 . . . . 0.0 110.26 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -117.98 149.46 40.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.254 -0.904 . . . . 0.0 109.221 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.422 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 16.9 m95 -91.62 163.2 14.2 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.105 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.432 ' OH ' ' HB2' ' A' ' 20' ' ' LYS . 34.0 m-85 -140.39 173.91 11.04 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.38 -0.825 . . . . 0.0 110.841 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.427 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 11.1 m80 -108.77 -176.92 3.17 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.361 -0.837 . . . . 0.0 109.52 177.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 48.7 mm -97.48 -60.45 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -80.1 -43.14 22.25 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.782 -1.199 . . . . 0.0 109.388 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.427 ' HB3' ' CB ' ' A' ' 52' ' ' HIS . 19.3 t -63.12 -27.99 69.76 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.71 178.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -83.2 -54.34 5.09 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.725 -1.234 . . . . 0.0 108.648 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.471 ' CD1' ' CD2' ' A' ' 93' ' ' HIS . 13.0 m-85 -59.61 -26.55 65.56 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.72 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.71 -38.98 86.89 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.833 -1.167 . . . . 0.0 109.375 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.5 tttm -67.96 -40.65 83.17 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.281 178.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.75 -41.76 96.06 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.239 -0.913 . . . . 0.0 109.081 179.031 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -56.17 -33.41 65.22 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.245 -0.909 . . . . 0.0 109.695 178.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.3 mtp-105 -103.68 29.87 5.46 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.316 -0.865 . . . . 0.0 110.573 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -113.17 168.42 9.73 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.948 -1.095 . . . . 0.0 110.026 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 -63.18 154.76 30.22 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.173 -0.954 . . . . 0.0 110.137 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.97 -33.92 19.46 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.168 -0.957 . . . . 0.0 110.751 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -49.46 -32.88 12.86 Favored 'General case' 0 N--CA 1.515 2.805 0 O-C-N 120.882 -1.136 . . . . 0.0 111.344 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 35.6 m -104.07 120.06 40.27 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.924 -1.11 . . . . 0.0 110.069 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.3 mmtt -116.82 144.34 44.61 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.202 -0.936 . . . . 0.0 110.267 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.7 mtpt -138.35 154.32 48.96 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.243 -0.91 . . . . 0.0 110.183 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.3 97.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.174 -0.953 . . . . 0.0 110.642 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -114.79 136.2 53.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.147 -0.97 . . . . 0.0 110.333 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.67 -178.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.043 -1.036 . . . . 0.0 110.919 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 62.3 tp -114.4 81.22 1.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.291 -0.881 . . . . 0.0 110.374 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -172.17 -51.63 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 110.722 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -51.19 -36.77 43.0 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.11 -0.994 . . . . 0.0 110.425 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 1.4 mp -63.46 152.33 38.68 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.136 -0.978 . . . . 0.0 109.451 179.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -102.1 116.29 32.36 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.187 -0.946 . . . . 0.0 110.307 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.08 -36.12 1.77 Allowed Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.909 -1.139 . . . . 0.0 110.467 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -51.53 -32.24 27.12 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.894 -1.357 . . . . 0.0 111.021 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -56.7 -39.87 74.63 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.907 -1.121 . . . . 0.0 110.126 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.61 -41.16 93.04 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.169 -0.957 . . . . 0.0 109.629 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.8 mp -47.67 165.55 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.913 0 O-C-N 121.291 -0.881 . . . . 0.0 110.875 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -88.47 161.37 17.05 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.226 -0.921 . . . . 0.0 109.823 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -56.32 -38.27 71.09 Favored 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.15 -0.968 . . . . 0.0 110.687 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -71.89 -40.42 68.91 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.182 -0.949 . . . . 0.0 109.707 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.409 ' OE2' ' OH ' ' A' ' 10' ' ' TYR . 6.1 mm-40 -73.4 -36.16 65.97 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.222 -0.924 . . . . 0.0 109.346 178.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 12.7 tttm -69.56 -37.67 77.12 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.117 -0.989 . . . . 0.0 109.625 178.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.402 ' O ' ' OG1' ' A' ' 91' ' ' THR . 31.8 tt0 -64.55 -39.49 93.85 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.211 -0.931 . . . . 0.0 109.667 179.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -59.82 -34.03 72.53 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.423 HG22 HD11 ' A' ' 90' ' ' ILE . 96.5 mt -65.01 -39.92 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.02 -1.05 . . . . 0.0 109.571 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 73.8 p -61.82 -46.76 88.09 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.063 -1.023 . . . . 0.0 109.354 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -61.66 -38.96 89.69 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.267 -0.896 . . . . 0.0 108.897 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.471 ' CD2' ' CD1' ' A' ' 57' ' ' PHE . 42.1 t60 -57.22 -48.82 77.83 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.238 -0.914 . . . . 0.0 109.737 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.0 mt -69.49 -39.97 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.648 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.73 -35.98 81.51 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.683 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.31 -37.6 85.78 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.3 tp -74.93 -40.52 60.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.114 -0.991 . . . . 0.0 110.032 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.0 t -60.99 -44.0 98.04 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.219 -0.926 . . . . 0.0 109.882 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.4 t -144.12 116.54 8.56 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.252 -0.905 . . . . 0.0 110.272 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -116.73 -57.36 2.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.22 -0.925 . . . . 0.0 110.269 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.42 -178.27 4.17 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.159 -0.963 . . . . 0.0 110.236 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.06 53.24 1.95 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.261 -0.899 . . . . 0.0 110.195 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -73.5 -165.18 10.07 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.7 m -135.39 116.85 12.11 Favored Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.21 -1.17 . . . . 0.0 110.133 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.15 156.08 55.92 Favored 'Trans proline' 0 N--CA 1.486 1.038 0 O-C-N 123.144 1.076 . . . . 0.0 110.427 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -118.18 -57.59 2.07 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.275 -0.891 . . . . 0.0 110.121 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 16.1 mmmt -117.34 129.27 55.77 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.168 -0.958 . . . . 0.0 110.132 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.8 mtpt -117.33 -57.17 2.17 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.182 -0.949 . . . . 0.0 110.189 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.87 165.2 13.59 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.183 -0.948 . . . . 0.0 110.143 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 9.1 p -130.48 147.99 33.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.194 -0.941 . . . . 0.0 110.3 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.7 t -116.4 143.09 27.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.204 -0.935 . . . . 0.0 109.941 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -117.27 128.22 54.86 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.156 -0.965 . . . . 0.0 110.185 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.15 141.33 45.92 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.173 -0.954 . . . . 0.0 110.212 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -116.72 98.9 6.77 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.234 -0.916 . . . . 0.0 110.279 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.49 125.57 52.13 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.143 -0.973 . . . . 0.0 110.061 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 43.1 p -118.45 149.28 41.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.139 -0.975 . . . . 0.0 110.187 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.261 179.924 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.3 mtm . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 120.729 0.3 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.38 46.81 1.63 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.168 -0.958 . . . . 0.0 110.174 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -116.32 -56.29 2.31 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.237 -0.915 . . . . 0.0 110.254 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -138.62 134.55 33.88 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.19 -0.944 . . . . 0.0 110.348 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 -136.73 149.67 47.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.153 -0.967 . . . . 0.0 110.143 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.507 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 1.7 m-85 -120.55 149.82 41.83 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.268 -0.895 . . . . 0.0 110.472 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.0 t -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.251 -0.906 . . . . 0.0 109.666 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 20.0 m -102.79 106.21 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.143 -0.973 . . . . 0.0 110.671 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -118.26 158.95 24.21 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.917 -1.115 . . . . 0.0 110.476 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.428 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -101.69 144.4 30.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.49 -0.756 . . . . 0.0 109.819 179.797 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.95 102.04 0.14 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.245 -0.91 . . . . 0.0 109.879 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -123.42 110.81 15.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 0.0 110.167 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 52.94 88.51 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.06 -1.025 . . . . 0.0 110.708 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.16 131.36 2.76 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 69.1 p -129.86 140.63 50.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -1.175 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -159.01 148.6 18.93 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.168 -0.957 . . . . 0.0 111.477 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.0 126.26 38.08 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.232 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.475 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 21.1 p -64.25 126.33 27.41 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.261 -1.14 . . . . 0.0 110.837 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 17.3 mttm -75.59 156.71 34.7 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.87 15.07 10.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.974 -1.079 . . . . 0.0 111.492 -178.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.2 p -175.51 151.44 1.21 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.555 -1.341 . . . . 0.0 110.602 178.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.63 90.48 8.27 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.989 -1.069 . . . . 0.0 111.731 -177.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.412 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.3 tt0 -168.88 -175.13 2.27 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.257 -0.902 . . . . 0.0 110.64 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.34 153.59 46.87 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.082 -1.011 . . . . 0.0 109.395 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 79.5 mt -106.28 111.29 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.218 -0.926 . . . . 0.0 110.111 -179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.5 t -114.19 158.92 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.012 179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.08 133.22 23.28 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.245 -0.909 . . . . 0.0 111.0 -179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 105.17 6.12 39.72 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 120.163 -1.017 . . . . 0.0 111.754 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.9 p -127.05 135.86 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 119.77 1.785 . . . . 0.0 110.476 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.428 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 8.2 t -87.72 140.61 29.34 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.115 -0.99 . . . . 0.0 109.975 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 ptt-85 -135.07 144.31 47.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.198 -0.939 . . . . 0.0 110.324 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.417 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 19.0 mt -108.82 122.56 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 109.351 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.18 162.44 15.24 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.46 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 12.3 pttp -127.86 140.9 51.74 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.277 -1.131 . . . . 0.0 109.405 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.2 t -109.34 109.18 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.972 -1.08 . . . . 0.0 110.14 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.2 t -121.12 112.62 33.12 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.211 -0.93 . . . . 0.0 109.915 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.96 137.15 26.19 Favored 'Trans proline' 0 N--CA 1.486 1.059 0 O-C-N 123.118 1.062 . . . . 0.0 110.356 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -103.78 117.96 58.49 Favored Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -74.14 71.76 4.26 Favored 'Trans proline' 0 N--CA 1.484 0.934 0 O-C-N 123.098 1.052 . . . . 0.0 110.332 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -146.71 -58.8 0.29 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.092 -1.005 . . . . 0.0 110.445 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.5 m -107.5 157.64 17.85 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.113 -0.992 . . . . 0.0 110.182 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -95.27 -38.95 10.31 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.191 -0.943 . . . . 0.0 110.376 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 27.2 t -56.7 -39.74 74.38 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.062 -1.024 . . . . 0.0 110.163 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -85.83 101.46 2.58 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.84 -80.19 0.38 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -126.96 149.62 49.76 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.114 -1.227 . . . . 0.0 110.36 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.9 mtt -113.81 135.4 54.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.273 -0.892 . . . . 0.0 110.123 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 22.3 ttmt -121.75 135.37 54.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.17 -0.956 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -113.09 145.25 41.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.163 -0.96 . . . . 0.0 109.598 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.409 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 11.9 m95 -104.14 112.24 25.16 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.052 -1.03 . . . . 0.0 111.074 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -124.13 173.68 8.14 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.399 176.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.475 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.8 m80 -93.41 177.66 5.96 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.475 -0.766 . . . . 0.0 110.693 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.415 HG22 ' CE2' ' A' ' 57' ' ' PHE . 30.3 mt -77.24 -54.83 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -57.46 -38.03 73.82 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.032 -1.042 . . . . 0.0 109.695 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 18.8 m -62.3 -50.15 72.79 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.133 -0.979 . . . . 0.0 109.085 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.43 -44.83 67.09 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.388 -0.82 . . . . 0.0 109.522 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.415 ' CE2' HG22 ' A' ' 53' ' ' ILE . 11.4 m-85 -64.47 -29.52 70.56 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.613 179.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -62.21 -42.05 98.94 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.854 -1.154 . . . . 0.0 109.091 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.4 -40.84 73.68 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.734 178.52 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.42 -41.88 94.88 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.262 -0.899 . . . . 0.0 108.882 178.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -60.11 -35.09 74.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.474 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.72 31.56 5.18 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.264 -0.897 . . . . 0.0 110.558 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -106.9 166.91 10.25 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.85 -1.156 . . . . 0.0 110.1 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.5 mtp180 -65.07 155.38 34.94 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.2 -0.938 . . . . 0.0 110.143 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.78 3.15 46.33 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.273 -0.892 . . . . 0.0 112.086 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -84.37 -34.79 23.53 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.547 -1.346 . . . . 0.0 110.699 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.31 135.42 43.93 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.074 -1.016 . . . . 0.0 110.193 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.0 mmmt -115.21 144.35 43.84 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.188 -0.945 . . . . 0.0 110.22 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -134.87 143.15 46.82 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.223 -0.923 . . . . 0.0 110.265 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.2 mt 54.86 101.02 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.172 -0.955 . . . . 0.0 110.782 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.23 135.6 44.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.144 -0.973 . . . . 0.0 109.452 179.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 54.64 -162.75 0.13 Allowed 'General case' 0 N--CA 1.502 2.138 0 O-C-N 120.944 -1.098 . . . . 0.0 109.977 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.462 ' CD1' ' OG1' ' A' ' 91' ' ' THR . 0.7 OUTLIER -132.48 39.08 3.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.022 -1.049 . . . . 0.0 110.602 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.03 35.87 0.84 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.206 -0.934 . . . . 0.0 110.481 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -133.65 37.26 3.3 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.099 -1.001 . . . . 0.0 109.923 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.409 ' O ' ' CD1' ' A' ' 79' ' ' TRP . 96.5 mt -136.35 152.73 50.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.228 -0.92 . . . . 0.0 109.75 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -81.16 110.31 16.54 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.069 -1.019 . . . . 0.0 110.097 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.31 -34.75 1.61 Allowed Glycine 0 N--CA 1.494 2.544 0 C-N-CA 119.691 -1.242 . . . . 0.0 111.073 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.412 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 20.2 p-90 -63.95 -31.11 72.18 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.12 1.46 . . . . 0.0 110.759 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.412 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.0 tt0 -52.88 -35.17 57.52 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.829 -1.17 . . . . 0.0 110.596 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -82.64 -33.37 27.87 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.031 -1.043 . . . . 0.0 110.291 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.408 HD12 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -51.26 176.68 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.872 0 O-C-N 120.916 -1.115 . . . . 0.0 110.555 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -104.22 160.83 14.55 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.123 -0.986 . . . . 0.0 110.416 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.94 -43.33 95.06 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.197 -0.939 . . . . 0.0 110.313 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -61.62 -50.76 71.28 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.701 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.25 -38.59 89.84 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.481 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 4.3 ttpm? -60.52 -38.66 85.11 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.219 -0.926 . . . . 0.0 109.727 179.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -57.64 -38.19 74.63 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.195 -0.941 . . . . 0.0 110.049 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.26 -38.32 76.68 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.086 -1.009 . . . . 0.0 110.255 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.3 mt -64.66 -39.34 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 121.047 -1.033 . . . . 0.0 109.352 179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.462 ' OG1' ' CD1' ' A' ' 73' ' ' LEU . 33.6 m -57.35 -39.54 76.14 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -56.86 -39.11 73.7 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.206 -0.934 . . . . 0.0 109.837 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 7.7 m-70 -61.9 -54.27 44.33 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.235 -0.916 . . . . 0.0 109.642 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -62.77 -38.38 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.273 -0.971 . . . . 0.0 109.218 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -38.48 89.02 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.241 -0.912 . . . . 0.0 109.766 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -60.77 -46.67 89.56 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 109.541 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.7 mp -59.25 -35.12 73.12 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.271 -0.893 . . . . 0.0 110.014 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.0 m -102.41 69.64 1.12 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.16 -0.963 . . . . 0.0 110.169 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.443 ' OG ' ' N ' ' A' ' 100' ' ' LYS . 16.0 t -106.55 -165.32 1.07 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.094 -1.004 . . . . 0.0 110.04 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.443 ' N ' ' OG ' ' A' ' 99' ' ' SER . 0.4 OUTLIER -115.28 -58.78 2.09 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.11 -0.994 . . . . 0.0 110.498 -179.812 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -150.15 136.82 19.14 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.114 -0.991 . . . . 0.0 110.662 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.01 84.71 1.6 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.184 -0.947 . . . . 0.0 110.408 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -128.15 -172.71 13.27 Favored Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 7.6 p -132.29 148.92 71.63 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.143 -1.21 . . . . 0.0 110.261 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.14 85.66 1.2 Allowed 'Trans proline' 0 C--N 1.316 -1.135 0 O-C-N 123.383 1.202 . . . . 0.0 110.457 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -142.6 162.93 34.2 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.193 -0.942 . . . . 0.0 110.27 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -116.81 -63.42 1.45 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.253 -0.904 . . . . 0.0 110.146 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -130.91 167.15 19.45 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.224 -0.922 . . . . 0.0 110.229 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.41 161.39 19.63 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.216 -0.928 . . . . 0.0 110.139 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 7.6 p -130.38 149.36 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.245 -0.909 . . . . 0.0 110.252 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.6 m -138.01 144.5 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.249 -0.907 . . . . 0.0 110.365 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -133.13 88.52 2.51 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.1 -1.0 . . . . 0.0 110.181 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.58 127.47 50.95 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.196 -0.94 . . . . 0.0 110.225 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -120.15 100.48 7.22 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.168 -0.958 . . . . 0.0 110.277 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.3 mt -116.58 128.4 55.37 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.219 -0.926 . . . . 0.0 110.19 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -139.06 98.15 3.46 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.227 -0.921 . . . . 0.0 110.227 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.169 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttp . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.53 70.69 1.37 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.151 -0.968 . . . . 0.0 110.342 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -120.67 -58.18 1.85 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.11 -0.994 . . . . 0.0 110.084 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -129.41 109.32 10.98 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.194 -0.941 . . . . 0.0 110.023 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -139.38 139.14 37.09 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.17 -0.956 . . . . 0.0 110.337 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.51 ' CE2' ' OH ' ' A' ' 51' ' ' TYR . 2.0 m-85 -115.98 146.63 41.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.254 -0.904 . . . . 0.0 109.999 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.4 m -130.16 159.59 36.36 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.218 -0.926 . . . . 0.0 109.189 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 22.8 m -125.69 105.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.019 -1.051 . . . . 0.0 111.061 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -100.44 141.74 32.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.949 -1.095 . . . . 0.0 109.576 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.437 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 46.8 m-85 -103.99 133.57 48.72 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.22 -0.925 . . . . 0.0 109.721 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.14 133.41 54.99 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -118.25 -58.28 2.0 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -153.68 39.23 0.48 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.168 -0.958 . . . . 0.0 110.642 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -139.25 171.63 23.59 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 m -145.08 127.25 15.69 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.198 -1.177 . . . . 0.0 110.476 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -149.17 143.83 26.2 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.206 -0.934 . . . . 0.0 110.813 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.19 128.0 44.78 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 108.749 -1.74 . . . . 0.0 108.749 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.445 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 32.0 p -64.35 122.55 16.96 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.222 -1.163 . . . . 0.0 110.811 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.462 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -68.34 157.25 36.09 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.349 -0.844 . . . . 0.0 108.838 179.69 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 15.79 10.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.842 -1.161 . . . . 0.0 111.83 -179.035 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.9 p -175.29 150.09 1.11 Allowed 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.566 -1.334 . . . . 0.0 110.699 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -86.85 89.13 7.86 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.008 -1.058 . . . . 0.0 111.784 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -165.66 -173.34 2.7 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.308 -0.87 . . . . 0.0 110.409 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -130.32 149.75 51.87 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.014 -1.054 . . . . 0.0 109.499 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.5 mt -102.7 134.35 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.263 -0.898 . . . . 0.0 110.006 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.9 m -136.6 169.2 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.267 -0.896 . . . . 0.0 110.322 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.19 127.33 10.44 Favored 'General case' 0 N--CA 1.516 2.857 0 O-C-N 121.583 -0.698 . . . . 0.0 110.948 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.53 8.81 48.58 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.097 -1.049 . . . . 0.0 111.156 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.1 t -111.2 135.65 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.547 1.673 . . . . 0.0 110.014 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.7 t -91.44 123.06 34.58 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.302 -0.874 . . . . 0.0 108.679 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -106.95 133.82 51.03 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.16 -0.963 . . . . 0.0 110.652 -179.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.405 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 6.2 mt -106.47 113.1 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.02 135.54 12.2 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 119.723 -1.227 . . . . 0.0 110.361 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 6' ' ' PHE . 3.4 ttpm? -111.99 123.93 51.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -1.07 . . . . 0.0 108.986 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.2 t -109.29 108.99 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.132 -0.98 . . . . 0.0 110.272 -179.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 33.2 m -123.6 146.94 51.59 Favored Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.215 -0.928 . . . . 0.0 110.24 179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.87 146.25 33.0 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.393 1.207 . . . . 0.0 110.173 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -102.95 116.42 62.52 Favored Pre-proline 0 N--CA 1.499 1.996 0 O-C-N 121.176 -0.953 . . . . 0.0 110.227 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -75.16 -171.27 0.95 Allowed 'Trans proline' 0 C--N 1.32 -0.963 0 O-C-N 123.192 1.101 . . . . 0.0 110.302 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 69.2 t80 63.06 -68.41 0.08 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.492 -0.755 . . . . 0.0 111.614 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.8 t -76.53 152.01 36.17 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.74 -1.225 . . . . 0.0 110.05 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.68 -47.12 4.73 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.242 -0.911 . . . . 0.0 110.408 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.5 t -57.26 -39.3 75.32 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.027 -1.045 . . . . 0.0 110.374 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.07 118.18 7.91 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.1 -85.25 1.72 Allowed Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -129.36 144.79 51.38 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.23 -1.159 . . . . 0.0 110.112 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 tpt -117.9 146.22 44.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.167 -0.958 . . . . 0.0 110.766 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.3 ptpt -131.87 144.78 51.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.24 -0.913 . . . . 0.0 109.671 179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -135.56 145.37 46.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.037 -1.04 . . . . 0.0 110.45 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -97.85 115.86 28.91 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.166 -0.959 . . . . 0.0 110.53 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.51 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.8 171.36 11.29 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.073 -1.017 . . . . 0.0 109.989 177.859 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.445 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 63.0 m80 -88.44 163.04 16.16 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.418 HG23 ' CD2' ' A' ' 93' ' ' HIS . 33.4 mt -67.6 -48.12 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -61.14 -40.75 95.0 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.163 -0.961 . . . . 0.0 109.334 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 35.6 m -64.1 -44.64 91.7 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.268 179.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 5.5 ttp -72.44 -43.26 64.03 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.429 -0.795 . . . . 0.0 109.993 -179.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -71.86 -29.75 64.7 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.794 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -78.5 -39.5 38.04 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 120.787 -1.195 . . . . 0.0 109.244 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -73.2 -35.78 66.41 Favored 'General case' 0 N--CA 1.505 2.28 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.367 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 tp -73.37 -40.03 64.69 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.229 -0.919 . . . . 0.0 109.409 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 19.6 mt-10 -69.85 -27.46 64.86 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.061 -1.025 . . . . 0.0 110.349 179.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.22 -36.3 10.08 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.917 -1.114 . . . . 0.0 110.966 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.14 151.43 50.69 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.956 -1.09 . . . . 0.0 111.075 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.48 104.14 9.75 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.266 -0.896 . . . . 0.0 109.702 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -87.27 -36.07 18.12 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.082 -1.011 . . . . 0.0 110.792 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.4 t -144.09 -163.61 1.71 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.039 -1.038 . . . . 0.0 110.265 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 16.0 m -102.62 105.23 15.68 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.123 -0.985 . . . . 0.0 110.116 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.5 mtpt -118.25 143.4 46.59 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.172 -0.955 . . . . 0.0 110.065 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -130.61 99.41 4.96 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.218 -0.926 . . . . 0.0 110.374 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.0 mt -114.59 99.01 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.237 -0.914 . . . . 0.0 109.814 179.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -108.84 132.91 53.56 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.293 -0.879 . . . . 0.0 109.801 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 51.24 -165.37 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.094 -1.004 . . . . 0.0 110.493 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 54.0 tp -122.0 84.22 2.22 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.102 -0.999 . . . . 0.0 110.032 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -155.72 -54.85 0.09 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.236 -0.915 . . . . 0.0 110.964 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -47.73 -32.71 6.13 Favored 'General case' 0 N--CA 1.518 2.948 0 O-C-N 121.074 -1.016 . . . . 0.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 7.4 mp -72.69 153.18 41.31 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.054 -1.029 . . . . 0.0 110.218 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -99.65 136.46 39.55 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.266 -0.896 . . . . 0.0 110.697 -179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.33 -35.07 2.66 Favored Glycine 0 N--CA 1.494 2.563 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 44.3 p-90 -67.29 -15.36 63.65 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 120.923 -1.34 . . . . 0.0 112.123 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -51.19 -37.67 47.94 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.556 -1.34 . . . . 0.0 111.356 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -169.3 54.89 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 120.979 -1.076 . . . . 0.0 112.071 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 14.0 mt -111.4 -70.36 0.82 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 109.926 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -122.49 131.17 53.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.072 -1.017 . . . . 0.0 110.133 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -88.16 -50.68 6.22 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.081 -1.012 . . . . 0.0 109.966 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -66.55 -41.74 88.19 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.971 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.381 178.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.1 tttt -58.09 -38.93 77.35 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.117 -0.989 . . . . 0.0 109.879 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 2.8 tm-20 -60.93 -40.34 92.85 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.244 -0.91 . . . . 0.0 109.794 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.77 92.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.13 -0.981 . . . . 0.0 110.101 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 11.3 mt -62.19 -40.42 87.55 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 121.191 -0.943 . . . . 0.0 109.746 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 67.3 p -61.51 -39.13 89.87 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.123 -0.986 . . . . 0.0 109.94 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -58.88 -39.87 82.67 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.179 -0.951 . . . . 0.0 109.962 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.418 ' CD2' HG23 ' A' ' 53' ' ' ILE . 7.8 m-70 -58.6 -46.15 87.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.171 -0.956 . . . . 0.0 110.163 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.0 mp -61.96 -41.56 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.169 -0.957 . . . . 0.0 108.927 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.34 83.04 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.499 -0.881 . . . . 0.0 109.926 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -71.6 -38.31 70.86 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.136 -0.978 . . . . 0.0 109.81 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 38.0 tp -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.123 -0.985 . . . . 0.0 110.598 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 39.5 t -91.89 -40.68 11.03 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.973 -1.079 . . . . 0.0 110.034 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.62 155.82 30.29 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.186 -0.946 . . . . 0.0 110.115 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -131.82 43.2 3.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.132 -0.98 . . . . 0.0 110.22 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 52.7 75.56 0.23 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.048 -1.033 . . . . 0.0 110.761 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -128.09 80.18 1.94 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.18 -0.95 . . . . 0.0 110.202 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -125.09 83.64 0.35 Allowed Glycine 0 N--CA 1.493 2.489 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.9 p -130.69 84.38 58.97 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.182 -1.187 . . . . 0.0 110.226 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.16 75.26 2.86 Favored 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.419 1.221 . . . . 0.0 110.346 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -138.13 46.12 2.07 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.146 -0.971 . . . . 0.0 110.297 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -131.47 105.58 7.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.241 -0.912 . . . . 0.0 110.006 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -116.41 -56.47 2.29 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.217 -0.927 . . . . 0.0 110.327 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.09 136.87 52.67 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.214 -0.928 . . . . 0.0 110.164 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 34.0 m -130.45 147.59 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.193 -0.942 . . . . 0.0 110.355 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.5 t -138.39 143.3 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.185 -0.947 . . . . 0.0 110.06 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -117.63 91.54 3.6 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.198 -0.939 . . . . 0.0 110.29 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -122.91 135.44 54.5 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.259 -0.9 . . . . 0.0 110.239 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 28.6 mtmt -123.78 144.8 49.47 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.282 -0.886 . . . . 0.0 110.247 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.7 tp -123.6 140.51 52.93 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.229 -0.919 . . . . 0.0 110.207 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 29.6 p -119.31 119.36 33.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.21 -0.931 . . . . 0.0 110.164 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.8 m . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 118.043 -0.979 . . . . 0.0 110.214 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 mmt . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 120.754 0.312 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.01 166.39 24.93 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.129 -0.982 . . . . 0.0 110.182 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -131.95 40.41 3.36 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.225 -0.922 . . . . 0.0 110.228 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -132.2 152.76 51.15 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.286 -0.884 . . . . 0.0 110.143 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -142.36 145.79 34.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.218 -0.926 . . . . 0.0 110.381 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.529 ' CE2' ' OH ' ' A' ' 51' ' ' TYR . 1.7 m-85 -116.69 147.04 42.34 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.193 -0.942 . . . . 0.0 110.202 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.8 t -128.01 148.24 50.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.329 -0.857 . . . . 0.0 108.884 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 16.9 m -128.82 109.47 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.063 -1.023 . . . . 0.0 110.824 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -123.47 161.46 24.81 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.11 -0.994 . . . . 0.0 110.69 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.429 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -102.39 155.64 18.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.495 -0.753 . . . . 0.0 110.072 179.901 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.33 140.01 30.35 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.357 -0.839 . . . . 0.0 110.019 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.3 mttm -114.88 -62.36 1.61 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.149 -0.97 . . . . 0.0 110.269 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -139.35 39.61 2.08 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.255 -0.903 . . . . 0.0 110.335 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.25 124.7 2.59 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.3 p -113.75 146.03 40.49 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.198 -1.178 . . . . 0.0 110.163 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -158.15 147.87 19.85 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.227 -0.921 . . . . 0.0 111.175 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.92 121.39 18.49 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 108.761 -1.735 . . . . 0.0 108.761 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.463 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 27.0 p -63.93 123.34 18.73 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.306 -1.114 . . . . 0.0 110.897 -178.326 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.437 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 46.8 mttt -71.59 156.05 39.84 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.577 -0.702 . . . . 0.0 109.256 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 65.51 16.01 10.31 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.875 -1.141 . . . . 0.0 111.638 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.0 p -174.74 150.48 1.32 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.592 -1.318 . . . . 0.0 110.534 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.5 92.28 9.12 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.476 -178.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.421 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.65 -174.68 2.55 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 110.667 179.243 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -131.63 153.3 50.08 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.105 -0.997 . . . . 0.0 109.228 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 80.8 mt -107.91 139.28 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.195 -0.94 . . . . 0.0 110.592 -179.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.1 t -137.58 161.46 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.435 -0.791 . . . . 0.0 109.477 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -47.35 130.06 13.17 Favored 'General case' 0 N--CA 1.517 2.899 0 O-C-N 121.318 -0.864 . . . . 0.0 111.187 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 106.37 8.47 33.12 Favored Glycine 0 N--CA 1.496 2.667 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.992 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.8 p -124.38 136.09 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 CA-C-N 119.909 1.855 . . . . 0.0 110.441 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.429 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.7 t -83.67 141.84 31.2 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.187 -0.946 . . . . 0.0 109.959 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 27.7 mtm180 -119.47 146.6 45.27 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.148 -0.97 . . . . 0.0 110.743 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.417 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 5.4 mt -121.22 111.26 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.74 137.94 13.66 Favored Glycine 0 N--CA 1.494 2.54 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.116 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HB2' ' CZ ' ' A' ' 6' ' ' PHE . 74.2 tttt -108.0 125.32 51.39 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.333 -1.098 . . . . 0.0 109.174 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 55.9 t -101.15 115.15 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.129 -0.982 . . . . 0.0 110.193 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.6 t -117.22 113.55 39.1 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.245 -0.909 . . . . 0.0 109.812 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.6 148.66 53.88 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 123.201 1.106 . . . . 0.0 110.481 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -103.09 165.36 13.75 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.31 -38.78 8.28 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.439 1.231 . . . . 0.0 110.26 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -109.45 154.04 23.18 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.179 -0.951 . . . . 0.0 109.729 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.401 ' O ' ' OG ' ' A' ' 41' ' ' SER . 25.9 p -115.62 103.42 10.7 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.201 -0.937 . . . . 0.0 110.465 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -103.05 -66.93 0.91 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.205 -0.934 . . . . 0.0 110.064 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.29 -43.59 10.27 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.171 -0.956 . . . . 0.0 110.171 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -145.38 -75.34 0.02 OUTLIER Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.846 -1.302 . . . . 0.0 109.846 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 141.21 -45.16 0.98 Allowed Glycine 0 N--CA 1.494 2.519 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.17 127.2 55.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.213 -1.169 . . . . 0.0 110.033 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 54.8 ttp -117.42 147.58 42.56 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.147 -0.971 . . . . 0.0 110.545 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 pttm -131.3 143.77 50.78 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 109.857 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -120.43 136.23 54.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.155 -0.966 . . . . 0.0 110.026 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -91.89 112.95 25.08 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.052 -1.03 . . . . 0.0 110.362 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.529 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -125.91 172.05 10.22 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.889 177.494 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.463 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 66.4 m80 -89.63 172.61 8.83 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 119.792 -0.763 . . . . 0.0 110.681 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.42 HG22 ' CE2' ' A' ' 57' ' ' PHE . 37.4 mt -72.83 -53.51 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.65 -39.35 80.33 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.011 -1.056 . . . . 0.0 109.838 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.8 m -62.73 -46.65 87.09 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.116 -0.99 . . . . 0.0 109.486 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.4 tpt -74.25 -42.75 59.15 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.285 -0.885 . . . . 0.0 109.933 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.43 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 20.6 m-85 -70.16 -25.9 63.67 Favored 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 119.214 -0.994 . . . . 0.0 110.044 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -73.74 -38.73 64.65 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.741 -1.224 . . . . 0.0 109.358 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -63.73 -41.82 97.99 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.123 -0.986 . . . . 0.0 109.411 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -59.97 -41.09 91.23 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.357 -0.84 . . . . 0.0 109.826 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -66.32 -35.19 79.75 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.25 -0.906 . . . . 0.0 110.496 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -79.78 -36.77 36.64 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.089 -1.007 . . . . 0.0 110.237 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.8 129.08 56.56 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.09 -1.006 . . . . 0.0 110.117 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.6 tpt85 -114.39 102.02 9.7 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.166 -0.959 . . . . 0.0 110.216 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.61 3.24 53.21 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.241 -0.912 . . . . 0.0 111.983 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 m 55.72 37.61 29.08 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.414 -1.429 . . . . 0.0 110.421 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -116.89 160.94 20.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.194 -0.941 . . . . 0.0 110.008 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.3 mmmm -101.39 95.54 6.57 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.176 -0.953 . . . . 0.0 110.075 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -125.05 142.4 51.51 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.226 -0.921 . . . . 0.0 110.041 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.3 mt 53.17 92.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.036 -1.04 . . . . 0.0 110.319 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -110.57 136.74 49.23 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.194 -0.941 . . . . 0.0 110.022 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.33 -167.09 0.07 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.03 -1.044 . . . . 0.0 110.464 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 14.9 tp -117.02 38.56 3.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.194 -0.941 . . . . 0.0 110.791 -179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.23 37.11 0.84 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.164 -0.96 . . . . 0.0 110.535 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -131.64 37.32 3.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.206 -0.934 . . . . 0.0 109.894 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.404 ' O ' ' CD1' ' A' ' 79' ' ' TRP . 92.0 mt -140.43 152.95 46.1 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.186 -0.947 . . . . 0.0 109.79 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -84.69 98.85 10.45 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.159 -0.963 . . . . 0.0 110.186 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 153.45 -36.19 0.75 Allowed Glycine 0 N--CA 1.495 2.615 0 C-N-CA 119.65 -1.262 . . . . 0.0 110.99 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.404 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 27.4 p-90 -57.94 -29.79 65.44 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 120.928 -1.336 . . . . 0.0 111.029 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -52.41 -36.72 54.9 Favored 'General case' 0 N--CA 1.515 2.794 0 O-C-N 120.861 -1.15 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.59 -33.06 41.96 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.161 -0.962 . . . . 0.0 110.243 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.06 170.3 0.02 OUTLIER 'General case' 0 N--CA 1.518 2.94 0 O-C-N 121.024 -1.048 . . . . 0.0 110.934 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -107.56 161.13 15.12 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.177 -0.952 . . . . 0.0 110.515 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.92 -42.72 90.34 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.214 -0.929 . . . . 0.0 110.258 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -61.79 -51.94 66.24 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.264 -0.898 . . . . 0.0 109.483 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.402 ' OE2' ' CZ ' ' A' ' 10' ' ' TYR . 40.8 mt-10 -63.72 -40.0 95.67 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.006 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.3 ttpt -59.43 -38.35 80.46 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.351 -0.843 . . . . 0.0 109.845 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.413 ' O ' ' OG1' ' A' ' 91' ' ' THR . 7.4 mt-10 -63.21 -36.61 84.2 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.185 -0.947 . . . . 0.0 110.151 179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -68.93 -38.29 79.4 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.07 -1.019 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 9.3 mt -68.74 -38.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.409 179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.413 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 1.8 p -59.01 -37.71 77.55 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.946 -1.096 . . . . 0.0 109.521 178.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -56.4 -37.8 70.64 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.22 -0.925 . . . . 0.0 109.814 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.402 ' ND1' HG21 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.61 -54.35 48.09 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.125 -0.984 . . . . 0.0 109.711 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.43 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 9.4 mt -64.79 -39.34 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 C-N-CA 119.399 -0.92 . . . . 0.0 108.984 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.64 87.14 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.409 -0.916 . . . . 0.0 109.504 178.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.6 -49.23 77.42 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.075 -1.016 . . . . 0.0 109.341 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.65 -36.46 78.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.265 -0.897 . . . . 0.0 109.971 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.7 t -103.46 69.54 1.0 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.142 -0.973 . . . . 0.0 110.086 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.6 p -119.22 -172.3 2.28 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.0 110.162 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.1 mtpt -135.65 -179.06 5.42 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.205 -0.934 . . . . 0.0 110.167 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.48 40.26 3.78 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.225 -0.922 . . . . 0.0 110.238 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.99 111.92 11.94 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.242 -0.911 . . . . 0.0 110.233 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -68.29 -124.32 0.03 OUTLIER Glycine 0 N--CA 1.493 2.495 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 p -130.06 91.66 38.71 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.315 -1.109 . . . . 0.0 110.249 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.77 167.24 27.75 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.401 1.211 . . . . 0.0 110.374 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -135.73 102.37 5.06 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.179 -0.951 . . . . 0.0 110.225 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 30.3 mtpt -127.35 176.04 7.74 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.221 -0.924 . . . . 0.0 110.226 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -118.45 82.17 1.8 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.221 -0.924 . . . . 0.0 110.195 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -122.93 161.17 24.68 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.206 -0.934 . . . . 0.0 110.233 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.4 t -125.6 116.93 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.181 -0.95 . . . . 0.0 110.012 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.9 t -117.34 132.72 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.248 -0.907 . . . . 0.0 109.941 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -122.83 110.84 15.94 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.231 -0.918 . . . . 0.0 110.17 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -119.73 116.21 25.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.078 -1.014 . . . . 0.0 110.233 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 12.2 tttt -122.69 141.91 51.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.197 -0.94 . . . . 0.0 110.159 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.8 mt -126.02 149.67 48.67 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.246 -0.908 . . . . 0.0 110.291 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -119.86 134.12 55.35 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 61.8 m . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.245 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -133.41 -165.51 1.63 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.202 -0.936 . . . . 0.0 110.246 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -120.88 104.46 9.86 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.215 -0.928 . . . . 0.0 110.191 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -117.24 139.24 51.04 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.205 -0.934 . . . . 0.0 110.196 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.8 ttt85 -142.24 144.88 33.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.122 -0.986 . . . . 0.0 110.349 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.519 ' CE2' ' OH ' ' A' ' 51' ' ' TYR . 2.1 m-85 -117.71 140.58 49.48 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.206 -0.934 . . . . 0.0 110.203 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.3 t -130.97 125.51 33.57 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.172 -0.955 . . . . 0.0 109.372 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 11.1 m -103.66 134.23 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.135 -0.978 . . . . 0.0 110.352 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.32 108.11 5.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.195 -0.94 . . . . 0.0 110.318 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.436 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.4 OUTLIER -51.02 157.47 0.84 Allowed 'General case' 0 N--CA 1.514 2.752 0 O-C-N 121.135 -0.978 . . . . 0.0 110.528 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.44 139.99 32.63 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.306 -0.872 . . . . 0.0 110.002 179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -127.46 -58.47 1.26 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.222 -0.924 . . . . 0.0 110.501 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.22 140.53 26.64 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.17 -0.956 . . . . 0.0 110.328 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.31 149.14 16.73 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -116.07 128.52 55.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.19 -1.183 . . . . 0.0 109.938 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.43 131.38 29.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.125 -0.985 . . . . 0.0 110.948 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.6 124.02 35.07 Favored Glycine 0 N--CA 1.493 2.495 0 N-CA-C 108.284 -1.927 . . . . 0.0 108.284 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.477 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 22.3 p -64.93 125.78 25.93 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.181 -1.188 . . . . 0.0 111.005 -178.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 157.38 37.26 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.667 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 16.8 10.71 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.878 -1.139 . . . . 0.0 111.395 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.6 p -177.75 152.42 0.78 Allowed 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.564 -1.335 . . . . 0.0 110.548 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -89.57 92.12 8.96 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.992 -1.067 . . . . 0.0 111.541 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.422 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.93 -173.61 2.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.401 -0.812 . . . . 0.0 110.325 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -139.19 148.99 43.89 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.014 -1.054 . . . . 0.0 109.911 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 6.9 mt -112.25 131.0 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.174 -0.954 . . . . 0.0 109.7 179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 8.6 p -155.68 84.25 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.138 -0.976 . . . . 0.0 111.28 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 48.7 101.91 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.367 -0.833 . . . . 0.0 112.406 178.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 138.0 -22.03 3.13 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 119.392 -1.385 . . . . 0.0 112.219 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p -125.62 139.41 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 CA-C-N 119.737 1.769 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.436 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -80.18 141.6 35.51 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.202 -0.936 . . . . 0.0 109.81 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 2.8 ptt85 -129.5 143.74 50.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.225 -0.922 . . . . 0.0 110.276 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.437 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 12.3 mt -111.11 126.48 68.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.186 -0.946 . . . . 0.0 109.181 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.9 154.15 16.72 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 11.3 pttp -127.8 143.43 51.13 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.129 -1.218 . . . . 0.0 109.589 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.3 t -108.53 109.66 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.012 -1.055 . . . . 0.0 109.949 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.9 t -115.39 113.22 43.29 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.186 -0.947 . . . . 0.0 109.829 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.17 150.09 53.01 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 O-C-N 123.196 1.103 . . . . 0.0 110.427 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -102.37 163.31 17.92 Favored Pre-proline 0 N--CA 1.499 2.024 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.81 148.78 52.9 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.412 1.217 . . . . 0.0 110.339 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 54.31 97.83 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.024 -1.048 . . . . 0.0 110.711 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -133.28 123.76 26.08 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.128 -0.983 . . . . 0.0 110.015 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -102.78 -47.64 4.34 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.128 -0.982 . . . . 0.0 110.653 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.6 t -88.2 -44.11 11.11 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.099 -1.001 . . . . 0.0 110.407 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -148.34 -102.18 0.28 Allowed Glycine 0 N--CA 1.496 2.68 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 110.51 55.35 0.52 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -146.25 130.06 17.15 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.191 -1.182 . . . . 0.0 110.173 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.6 mtt -117.96 128.22 54.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.133 -0.979 . . . . 0.0 110.588 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -126.83 123.08 36.52 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.171 -0.956 . . . . 0.0 109.792 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -118.27 142.6 47.32 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.134 -0.978 . . . . 0.0 110.411 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -99.25 114.1 26.74 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.173 -0.954 . . . . 0.0 110.611 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.519 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.3 OUTLIER -124.79 174.15 8.11 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.018 -1.051 . . . . 0.0 109.811 177.495 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.477 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 64.4 m80 -92.92 -173.7 3.37 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.454 -0.779 . . . . 0.0 110.664 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.478 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 37.9 mm -82.93 -56.63 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -58.56 -38.74 78.49 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.18 -0.95 . . . . 0.0 109.49 178.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.9 m -60.33 -51.31 70.07 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.272 -0.893 . . . . 0.0 109.104 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.5 tpt -68.8 -45.42 71.31 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.446 -0.784 . . . . 0.0 109.374 179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 93' ' ' HIS . 9.5 m-85 -63.07 -30.24 71.44 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.244 -0.983 . . . . 0.0 109.949 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -65.7 -42.13 91.53 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.847 -1.158 . . . . 0.0 109.034 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -65.58 -41.04 93.33 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.277 -0.889 . . . . 0.0 108.979 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.5 mp -55.34 -41.02 71.94 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.139 -0.976 . . . . 0.0 109.152 178.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.11 -33.91 65.55 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.287 -0.883 . . . . 0.0 109.562 178.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -104.57 30.82 5.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.147 -0.97 . . . . 0.0 110.396 179.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -111.1 169.57 8.69 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.969 -1.082 . . . . 0.0 110.109 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.15 156.55 19.19 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.146 -0.971 . . . . 0.0 110.25 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.37 -33.59 65.14 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.26 -0.9 . . . . 0.0 110.748 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.42 -36.56 33.63 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 120.978 -1.076 . . . . 0.0 110.892 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.6 m -112.58 117.11 31.41 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.209 -0.932 . . . . 0.0 110.082 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.6 tttt -116.49 144.46 44.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.194 -0.941 . . . . 0.0 110.28 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.34 155.53 41.88 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.196 -0.94 . . . . 0.0 110.287 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.417 HG22 HD11 ' A' ' 70' ' ' ILE . 80.0 mt 54.14 99.11 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.178 -0.951 . . . . 0.0 110.797 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.9 132.35 54.28 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.0 109.729 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.94 -164.17 0.07 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.023 -1.048 . . . . 0.0 110.777 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 46.0 tp -114.02 -55.42 2.5 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.97 -36.99 60.82 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.014 -1.054 . . . . 0.0 110.724 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -50.62 -31.07 14.99 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.057 -1.027 . . . . 0.0 111.302 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 89.0 mt -87.35 152.19 22.48 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.889 -1.132 . . . . 0.0 110.305 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -96.31 137.13 35.84 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.243 -0.911 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.56 -49.44 0.85 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.447 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 55.6 p-90 -50.81 -32.0 18.75 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.116 -1.226 . . . . 0.0 111.151 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 3.8 tm-20 -53.52 -28.04 29.09 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.94 -1.1 . . . . 0.0 111.416 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -110.05 24.22 13.3 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.878 -1.139 . . . . 0.0 112.244 -179.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.424 HD11 ' CD2' ' A' ' 10' ' ' TYR . 21.6 mt -111.1 -164.8 0.94 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.723 -1.235 . . . . 0.0 109.678 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -88.02 161.85 17.14 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.926 -1.109 . . . . 0.0 110.312 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.13 -49.26 17.81 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.923 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -61.92 -42.7 99.39 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.305 -0.872 . . . . 0.0 109.366 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.426 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 21.3 mt-10 -62.58 -40.62 97.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.3 -39.81 84.19 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.208 -0.932 . . . . 0.0 109.932 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -58.36 -39.69 80.23 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.247 -0.908 . . . . 0.0 110.062 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -59.47 -35.82 74.82 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.444 HG22 HD11 ' A' ' 90' ' ' ILE . 47.9 mm -70.46 -38.39 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.1 -1.0 . . . . 0.0 109.434 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -38.86 92.82 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.031 -1.043 . . . . 0.0 109.391 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -57.23 -35.8 70.13 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.163 -0.961 . . . . 0.0 110.016 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.478 ' CE1' ' CG2' ' A' ' 53' ' ' ILE . 1.7 m-70 -55.57 -50.01 71.21 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.05 -1.031 . . . . 0.0 109.941 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.74 -38.24 81.81 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.314 -0.954 . . . . 0.0 109.15 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.8 -39.63 83.97 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.575 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.43 -39.92 94.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.19 -0.944 . . . . 0.0 109.414 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -82.52 -34.77 27.79 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.9 m -103.69 60.56 0.75 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.133 -0.979 . . . . 0.0 109.983 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.0 t -109.08 81.38 1.43 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.053 -1.03 . . . . 0.0 110.25 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -131.96 116.71 17.48 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.167 -0.958 . . . . 0.0 110.087 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 53.01 81.28 0.09 Allowed 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.095 -1.003 . . . . 0.0 110.701 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.42 -58.51 2.08 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.191 -0.943 . . . . 0.0 110.201 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 120.61 59.64 0.24 Allowed Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.5 p -140.17 95.33 8.42 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.264 -1.139 . . . . 0.0 110.154 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.43 162.81 40.43 Favored 'Trans proline' 0 C--N 1.317 -1.104 0 O-C-N 123.408 1.215 . . . . 0.0 110.398 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -140.91 106.76 5.14 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.234 -0.916 . . . . 0.0 110.199 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -122.7 81.39 1.85 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.202 -0.936 . . . . 0.0 110.236 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.4 mtpt -141.67 -175.17 4.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.251 -0.906 . . . . 0.0 110.149 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.51 114.17 20.85 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.237 -0.915 . . . . 0.0 110.291 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.64 126.11 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.156 -0.965 . . . . 0.0 109.985 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.4 p -137.76 144.66 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.225 -0.922 . . . . 0.0 110.193 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -119.53 89.23 3.09 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.037 -1.039 . . . . 0.0 110.171 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -132.62 127.52 35.14 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.133 -0.979 . . . . 0.0 110.327 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.6 ttpt -124.53 131.56 53.48 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.17 -0.956 . . . . 0.0 110.268 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.1 mt -123.31 139.88 53.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.202 -0.936 . . . . 0.0 110.242 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -124.02 149.44 46.05 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.231 -0.918 . . . . 0.0 110.194 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.228 179.998 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.2 mtp . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 64.34 -71.4 0.07 Allowed 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.218 -0.926 . . . . 0.0 110.838 179.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -140.76 42.72 1.84 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.988 -1.07 . . . . 0.0 110.221 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -147.44 133.33 19.09 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.257 -0.902 . . . . 0.0 110.456 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 -133.69 138.73 46.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.141 -0.974 . . . . 0.0 110.344 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.421 ' CZ ' ' HD2' ' A' ' 34' ' ' LYS . 0.9 OUTLIER -131.55 141.04 49.61 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.291 -0.881 . . . . 0.0 109.675 179.986 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -152.69 166.72 31.26 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.33 -0.856 . . . . 0.0 109.956 179.199 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.442 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 6.1 m -104.64 141.4 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 120.864 -1.148 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.436 ' CB ' ' CZ3' ' A' ' 50' ' ' TRP . 10.1 t0 -136.91 147.92 46.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.298 -0.877 . . . . 0.0 109.261 179.224 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.425 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 59.9 m-85 -102.48 154.29 19.23 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.22 -0.925 . . . . 0.0 110.311 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.08 133.9 34.21 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.26 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -134.15 106.06 6.98 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 52.97 95.07 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.041 -1.037 . . . . 0.0 110.806 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.6 144.38 4.81 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.709 -1.356 . . . . 0.0 109.709 179.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 p -117.77 134.49 54.86 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.219 -1.165 . . . . 0.0 110.125 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.83 134.35 49.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.189 -0.944 . . . . 0.0 110.721 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.82 124.62 31.18 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.4 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . 22.4 t -62.41 128.53 36.47 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.355 -1.086 . . . . 0.0 109.337 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 145.94 47.97 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.5 mttt 52.58 48.74 21.89 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.901 -1.124 . . . . 0.0 109.732 -179.231 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.69 151.42 9.2 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.351 -0.843 . . . . 0.0 110.656 -178.328 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -101.93 49.76 0.85 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.138 -0.976 . . . . 0.0 108.57 178.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.6 -174.1 4.23 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.474 -0.766 . . . . 0.0 110.18 -178.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -133.31 159.66 39.61 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.118 -0.989 . . . . 0.0 109.914 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 62.9 mt -104.51 105.02 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.409 -0.807 . . . . 0.0 109.526 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 12.8 p -104.65 161.66 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.188 -0.945 . . . . 0.0 110.583 -179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -46.13 138.57 5.17 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.466 -0.771 . . . . 0.0 111.195 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.02 0.77 51.64 Favored Glycine 0 N--CA 1.493 2.466 0 C-N-CA 120.163 -1.018 . . . . 0.0 111.036 -179.202 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 10.4 p -125.62 135.58 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-N 119.549 1.674 . . . . 0.0 109.86 179.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 21.0 t -89.44 138.84 31.09 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 -179.609 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.45 154.1 45.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.334 -0.854 . . . . 0.0 110.138 179.83 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.8 mt -102.07 136.53 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.18 -0.95 . . . . 0.0 110.185 -179.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.421 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.1 126.0 8.51 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.574 -1.81 . . . . 0.0 108.574 179.183 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HD2' ' CZ ' ' A' ' 6' ' ' PHE . 74.8 tttt -105.13 114.62 28.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.177 -1.19 . . . . 0.0 109.742 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -96.04 121.2 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.212 -0.93 . . . . 0.0 110.429 -179.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.7 t -119.86 110.75 36.39 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.215 -0.928 . . . . 0.0 109.417 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.03 147.61 43.49 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.24 1.126 . . . . 0.0 110.638 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -103.2 164.83 14.7 Favored Pre-proline 0 N--CA 1.499 2.014 0 O-C-N 121.268 -0.895 . . . . 0.0 110.006 179.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.65 178.19 5.39 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.392 1.207 . . . . 0.0 110.29 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 56.9 t80 62.96 -69.12 0.07 Allowed 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.509 -0.744 . . . . 0.0 111.333 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 t -114.79 122.42 46.32 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.668 -1.27 . . . . 0.0 110.175 179.857 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -101.79 -47.71 4.52 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.194 -0.941 . . . . 0.0 110.303 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.8 t -57.09 -40.4 76.91 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.072 -1.017 . . . . 0.0 110.248 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -114.08 40.76 2.38 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.2 71.0 0.33 Allowed Glycine 0 N--CA 1.495 2.586 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -143.56 142.47 31.11 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.175 -1.191 . . . . 0.0 110.299 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.6 mtt -116.39 140.59 49.18 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.21 -0.931 . . . . 0.0 110.148 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -129.75 122.64 29.27 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.133 -0.979 . . . . 0.0 110.54 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -116.65 145.45 43.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.142 -0.974 . . . . 0.0 109.694 179.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.436 ' CZ3' ' CB ' ' A' ' 9' ' ' ASP . 16.6 m95 -97.37 139.82 32.75 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.108 -0.995 . . . . 0.0 110.084 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -125.43 173.19 9.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 110.064 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.4 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 1.7 m80 -90.91 -172.67 3.43 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.526 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.455 ' CG2' ' CE1' ' A' ' 93' ' ' HIS . 44.5 mm -84.79 -40.29 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 120.962 -1.086 . . . . 0.0 109.161 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -86.45 -31.11 21.55 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.997 -1.064 . . . . 0.0 110.634 178.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 78.9 m -66.56 -51.01 61.17 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.951 -1.093 . . . . 0.0 109.923 179.807 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.22 -40.21 90.14 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.007 -179.716 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.488 ' CD2' ' CD2' ' A' ' 93' ' ' HIS . 5.8 m-85 -70.44 -32.62 70.28 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 118.938 -1.105 . . . . 0.0 109.553 178.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.96 -36.97 78.25 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.97 -1.081 . . . . 0.0 109.592 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -59.29 -40.18 85.33 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.122 -0.986 . . . . 0.0 109.787 179.469 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -57.72 -42.66 84.28 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.194 -0.942 . . . . 0.0 109.327 179.286 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.95 -34.04 71.31 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.625 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -107.55 31.01 5.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.19 -0.944 . . . . 0.0 110.639 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.48 166.99 10.55 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.995 -1.066 . . . . 0.0 110.136 179.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.9 ttt180 -64.5 155.31 33.26 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.229 -0.919 . . . . 0.0 110.05 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.54 -34.6 19.91 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.167 -0.958 . . . . 0.0 110.662 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.2 p -51.66 -36.57 46.85 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.896 -1.127 . . . . 0.0 110.829 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.1 m -111.61 131.54 55.2 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.153 -0.967 . . . . 0.0 110.171 179.845 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -117.05 144.04 45.08 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.212 -0.93 . . . . 0.0 110.347 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.8 mttt -119.19 133.8 55.56 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.261 -0.899 . . . . 0.0 110.227 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.437 HG23 HD11 ' A' ' 70' ' ' ILE . 74.5 mt 54.36 98.74 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.14 -0.975 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -112.82 137.55 50.99 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.086 -1.009 . . . . 0.0 109.996 179.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.42 -164.04 0.09 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.998 -1.063 . . . . 0.0 110.704 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.429 HD21 ' OG1' ' A' ' 91' ' ' THR . 56.6 tp -112.87 160.32 18.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.104 -0.997 . . . . 0.0 110.137 -179.778 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.422 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER 60.36 46.24 10.23 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.037 -1.039 . . . . 0.0 110.178 -179.829 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -112.91 -62.27 1.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.142 -0.974 . . . . 0.0 109.537 179.348 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.408 ' O ' ' O ' ' A' ' 6' ' ' PHE . 0.9 OUTLIER -138.3 65.62 1.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.266 -0.896 . . . . 0.0 109.491 178.732 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.442 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 10.2 pt-20 -143.01 141.87 31.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.858 -1.151 . . . . 0.0 110.956 179.492 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.76 68.54 1.89 Allowed Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.186 -1.566 . . . . 0.0 109.186 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.422 ' CE2' HG22 ' A' ' 74' ' ' THR . 58.6 p-90 -91.81 -32.87 15.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.147 -1.208 . . . . 0.0 111.207 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -52.54 -29.42 25.34 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.838 -1.164 . . . . 0.0 111.17 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -94.86 -38.73 10.6 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.852 -1.155 . . . . 0.0 110.618 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.425 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 92.5 mt -70.67 -175.69 1.13 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.949 -1.095 . . . . 0.0 110.015 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -63.91 150.13 45.67 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.225 -0.922 . . . . 0.0 110.16 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -88.45 -39.95 13.85 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.246 -0.909 . . . . 0.0 110.32 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -58.03 -40.82 81.83 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 121.245 -0.909 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.404 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.4 mt-10 -59.78 -39.56 85.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.285 -0.884 . . . . 0.0 109.764 179.624 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -58.69 -38.52 78.41 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.185 -0.947 . . . . 0.0 110.09 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -59.06 -45.69 90.15 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.733 179.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -59.17 -34.24 71.87 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.224 -0.922 . . . . 0.0 110.164 179.299 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.5 mm -58.9 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.056 -1.028 . . . . 0.0 109.439 179.419 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.429 ' OG1' HD21 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -57.69 -41.38 81.53 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.095 -1.003 . . . . 0.0 109.649 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -62.56 -41.55 98.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.214 179.207 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.488 ' CD2' ' CD2' ' A' ' 57' ' ' PHE . 72.9 t60 -60.65 -46.47 90.18 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.266 -0.896 . . . . 0.0 109.567 179.541 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.429 HG12 ' CE1' ' A' ' 57' ' ' PHE . 25.7 mt -62.41 -39.5 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.181 -0.95 . . . . 0.0 109.396 179.422 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.403 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -60.47 -39.97 89.57 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.202 -0.936 . . . . 0.0 109.717 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -61.44 -44.22 97.5 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.261 -0.9 . . . . 0.0 109.345 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.0 tp -60.23 -35.1 74.68 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.353 -0.842 . . . . 0.0 110.035 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.0 t -100.59 67.29 1.28 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.053 -1.029 . . . . 0.0 110.077 179.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 8.4 m -137.67 162.66 33.24 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.115 -0.991 . . . . 0.0 110.184 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -124.62 41.4 3.51 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.207 -0.933 . . . . 0.0 110.187 -179.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.06 81.99 1.82 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.222 -0.924 . . . . 0.0 110.165 179.963 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.99 -175.37 3.34 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.19 -0.943 . . . . 0.0 110.267 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -108.3 -153.9 17.15 Favored Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 28.4 p -142.16 97.25 6.34 Favored Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.15 -1.206 . . . . 0.0 110.268 -179.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.45 151.42 53.44 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.355 1.187 . . . . 0.0 110.433 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.4 tptp -117.65 102.95 9.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.192 -0.943 . . . . 0.0 110.214 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 7.8 mttm -139.86 130.37 25.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.228 -0.92 . . . . 0.0 110.21 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -119.65 50.37 1.27 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.19 -0.944 . . . . 0.0 110.2 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.07 156.71 27.09 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.215 -0.928 . . . . 0.0 110.22 179.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.2 t -116.52 136.57 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.168 -0.958 . . . . 0.0 109.919 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 61.0 t -121.0 118.34 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.177 -0.952 . . . . 0.0 109.911 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -121.0 106.61 11.76 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.219 -0.925 . . . . 0.0 110.184 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.22 141.18 51.11 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.259 -0.901 . . . . 0.0 110.215 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -116.78 137.04 52.48 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.183 -0.948 . . . . 0.0 110.21 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 82.2 mt -123.93 106.72 10.65 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.246 -0.908 . . . . 0.0 110.201 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.5 m -137.8 98.52 3.68 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.211 -0.93 . . . . 0.0 110.201 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.182 -179.994 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttt . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -127.14 68.59 1.28 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.241 -0.912 . . . . 0.0 110.2 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -118.17 -57.29 2.1 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.264 -179.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -114.64 149.34 36.82 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.125 -0.984 . . . . 0.0 110.2 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.24 153.79 42.63 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.222 -0.924 . . . . 0.0 110.393 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.525 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.6 OUTLIER -146.13 134.85 22.28 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.344 -0.848 . . . . 0.0 109.866 -179.943 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 p -152.73 165.49 35.13 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.052 -1.03 . . . . 0.0 109.871 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.418 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 11.1 m -101.81 116.23 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 120.91 -1.119 . . . . 0.0 110.606 179.618 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -105.0 141.78 35.97 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.019 -1.051 . . . . 0.0 109.239 179.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.424 ' CZ ' ' HB2' ' A' ' 83' ' ' GLU . 73.2 m-85 -100.35 152.14 20.67 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.156 -0.965 . . . . 0.0 110.192 -179.793 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -100.68 135.54 41.96 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.363 -0.836 . . . . 0.0 110.025 179.664 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 mtpt -114.18 -55.1 2.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.146 -0.971 . . . . 0.0 110.348 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -133.8 156.13 48.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.185 -0.947 . . . . 0.0 110.256 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 162.61 24.13 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 89.4 m -138.31 145.42 41.2 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.226 -1.161 . . . . 0.0 110.192 179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -140.92 141.85 34.49 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.218 -0.926 . . . . 0.0 110.736 -179.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.41 127.58 44.14 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.33 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.451 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 31.3 p -65.74 121.65 15.48 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.148 -1.207 . . . . 0.0 110.931 -178.425 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 29.7 mmtt -66.89 156.32 36.08 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.335 -0.853 . . . . 0.0 108.972 179.717 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.84 16.35 10.41 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.84 -1.163 . . . . 0.0 111.92 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.4 p -175.24 149.33 1.05 Allowed 'General case' 0 N--CA 1.504 2.256 0 O-C-N 120.571 -1.33 . . . . 0.0 110.726 178.095 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -86.64 88.36 7.65 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.021 -1.049 . . . . 0.0 111.678 -178.021 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -165.27 -173.73 2.96 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 179.01 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -130.81 153.8 48.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.019 -1.051 . . . . 0.0 109.833 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.4 mt -107.73 122.5 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.277 -0.889 . . . . 0.0 109.969 -179.986 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 12.2 p -120.09 160.3 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.243 -0.911 . . . . 0.0 110.323 179.867 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.7 pttt -47.83 132.04 14.84 Favored 'General case' 0 N--CA 1.515 2.821 0 O-C-N 121.386 -0.821 . . . . 0.0 111.28 -179.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.4 8.59 40.53 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.117 -1.039 . . . . 0.0 111.727 -179.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.7 p -124.97 137.01 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-N 119.723 1.762 . . . . 0.0 110.612 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.1 t -94.43 133.46 38.01 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.161 -0.962 . . . . 0.0 109.942 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.24 148.61 50.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.266 -0.896 . . . . 0.0 110.151 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.42 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 10.1 mt -104.36 123.89 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.083 -1.01 . . . . 0.0 109.425 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.436 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -106.02 143.93 15.77 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 179.569 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 27.4 tttt -108.37 117.17 33.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -1.136 . . . . 0.0 108.774 179.679 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -96.4 108.7 21.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.01 -1.056 . . . . 0.0 110.467 -179.421 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.0 p -123.62 143.43 41.7 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.301 -0.874 . . . . 0.0 110.041 179.354 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -76.22 143.77 25.69 Favored 'Trans proline' 0 C--N 1.317 -1.084 0 O-C-N 123.101 1.053 . . . . 0.0 110.342 -179.884 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -103.58 121.48 48.18 Favored Pre-proline 0 N--CA 1.5 2.033 0 O-C-N 121.189 -0.944 . . . . 0.0 110.088 179.783 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -72.2 79.37 1.75 Allowed 'Trans proline' 0 C--N 1.319 -0.996 0 O-C-N 123.127 1.067 . . . . 0.0 110.245 179.785 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -145.51 -58.56 0.33 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.222 -0.924 . . . . 0.0 110.458 -179.721 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.48 157.99 15.65 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.124 -0.985 . . . . 0.0 110.112 179.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -94.38 -35.36 12.4 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.232 -0.917 . . . . 0.0 110.768 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.55 -37.73 65.77 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 120.91 -1.119 . . . . 0.0 110.556 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 142.22 -176.66 22.04 Favored Glycine 0 N--CA 1.495 2.588 0 N-CA-C 109.661 -1.375 . . . . 0.0 109.661 179.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.23 137.27 3.27 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -132.77 151.42 52.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.205 -1.173 . . . . 0.0 110.038 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.6 ttp -113.6 130.99 56.28 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.226 -0.921 . . . . 0.0 110.53 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -139.15 136.77 35.46 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.948 . . . . 0.0 110.084 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -122.1 153.48 38.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.174 -0.954 . . . . 0.0 109.399 179.856 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.436 ' CZ3' ' HA2' ' A' ' 33' ' ' GLY . 16.1 m95 -107.5 114.1 27.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.109 -0.994 . . . . 0.0 111.033 -179.872 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -123.35 171.32 9.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.193 -0.942 . . . . 0.0 109.224 177.412 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.451 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 58.9 m80 -86.72 -175.19 5.32 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.269 -179.78 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.447 HG23 ' CG ' ' A' ' 93' ' ' HIS . 31.9 mm -85.33 -47.06 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 178.211 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -64.85 -40.01 94.46 Favored 'General case' 0 N--CA 1.504 2.234 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.056 178.126 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 51.1 m -62.09 -45.99 91.04 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.084 179.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -70.19 -46.65 64.15 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.414 -0.804 . . . . 0.0 109.661 179.86 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -67.13 -28.96 68.58 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.975 179.368 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -76.83 -42.74 39.15 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.777 -1.202 . . . . 0.0 108.899 178.545 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.2 tptp -66.77 -39.76 87.98 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.42 -0.912 . . . . 0.0 108.796 178.415 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.0 tp -55.74 -41.22 73.61 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.256 -0.902 . . . . 0.0 109.21 178.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -59.75 -34.86 73.5 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.288 -0.883 . . . . 0.0 109.555 178.542 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 -108.77 32.65 4.72 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.145 -0.972 . . . . 0.0 110.538 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -92.67 168.87 10.93 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.954 -1.092 . . . . 0.0 110.305 179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 mtt85 -62.76 157.57 20.8 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.262 -0.899 . . . . 0.0 110.415 -179.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.85 -33.4 68.62 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.22 -0.925 . . . . 0.0 110.79 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.0 p -92.97 57.69 2.82 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 120.895 -1.128 . . . . 0.0 110.013 179.811 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 6.7 p -117.31 163.12 16.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.259 -0.901 . . . . 0.0 110.072 -179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.0 ttpt -95.35 130.63 42.06 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.2 -0.937 . . . . 0.0 109.673 179.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 18.1 mtmt -113.02 159.25 19.34 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.209 -0.932 . . . . 0.0 110.563 -179.405 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.2 mt -111.37 120.2 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -114.05 152.78 30.5 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.273 -0.892 . . . . 0.0 109.724 179.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 52.86 -165.23 0.07 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.027 -1.046 . . . . 0.0 110.487 -179.753 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.421 ' O ' ' OG1' ' A' ' 74' ' ' THR . 1.6 tp -138.02 -164.78 1.68 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.147 -0.971 . . . . 0.0 110.162 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.421 ' OG1' ' O ' ' A' ' 73' ' ' LEU . 4.5 p 46.84 43.3 13.13 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.169 -0.957 . . . . 0.0 111.204 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -113.43 -55.84 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.251 -0.905 . . . . 0.0 110.055 179.833 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.412 ' CD2' ' N ' ' A' ' 76' ' ' LEU . 1.3 pt? -146.59 63.42 1.2 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.082 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.418 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 5.2 pt-20 -144.46 141.28 29.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.063 -1.023 . . . . 0.0 110.699 178.888 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.08 66.2 3.46 Favored Glycine 0 N--CA 1.496 2.672 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.439 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.422 ' CZ3' ' HD3' ' A' ' 87' ' ' LYS . 51.1 p-90 -90.91 -39.22 12.41 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.073 -1.251 . . . . 0.0 110.512 179.865 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.86 -24.13 67.44 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.227 -0.921 . . . . 0.0 111.072 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -95.96 -29.63 14.06 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.714 -1.241 . . . . 0.0 111.497 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.1 mt -94.77 -79.79 0.42 Allowed 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.8 -1.187 . . . . 0.0 110.773 -179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.424 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 5.8 mt-10 -125.39 132.62 52.74 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.7 -1.25 . . . . 0.0 110.829 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -89.07 -43.94 10.72 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.13 -0.981 . . . . 0.0 109.554 178.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -62.02 -40.99 97.56 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.365 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -56.08 -38.99 71.43 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.219 -0.925 . . . . 0.0 109.683 179.058 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.422 ' HD3' ' CZ3' ' A' ' 79' ' ' TRP . 1.3 ttpt -55.53 -38.17 68.9 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.08 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.4 -44.17 97.61 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 109.607 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -64.11 -39.07 93.25 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.261 -0.899 . . . . 0.0 109.883 179.633 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 12.6 mt -61.41 -35.1 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.219 -0.925 . . . . 0.0 109.546 179.367 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 3.7 m -60.77 -38.95 86.99 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.812 -1.18 . . . . 0.0 109.576 179.134 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -57.13 -38.53 73.6 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.266 -0.896 . . . . 0.0 109.901 179.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.447 ' CG ' HG23 ' A' ' 53' ' ' ILE . 1.9 m-70 -53.05 -43.47 66.68 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.06 -1.025 . . . . 0.0 110.178 179.753 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 1.5 mp -65.97 -40.55 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.323 -0.951 . . . . 0.0 108.873 179.506 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.49 -36.95 81.93 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.969 179.312 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -70.63 -37.75 73.83 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.2 tp -79.73 -31.94 41.12 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.046 -1.034 . . . . 0.0 110.736 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.3 m -92.04 -39.48 11.62 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.192 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.9 m -115.65 114.0 24.29 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.081 -1.012 . . . . 0.0 110.1 179.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -117.66 -57.57 2.11 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.179 -0.95 . . . . 0.0 110.284 -179.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -116.92 -61.08 1.77 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.189 -0.944 . . . . 0.0 110.188 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.91 43.48 3.12 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.247 -0.908 . . . . 0.0 110.156 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -94.06 91.95 1.51 Allowed Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 29.9 p -120.46 66.95 13.02 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.21 -1.171 . . . . 0.0 110.175 179.939 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.9 -43.15 0.86 Allowed 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.284 1.15 . . . . 0.0 110.454 -179.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.5 mttt -118.26 137.26 53.17 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.196 -0.94 . . . . 0.0 110.284 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.2 ttmm -116.83 -56.53 2.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.167 -0.958 . . . . 0.0 110.239 -179.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -129.14 52.87 1.92 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.126 -0.984 . . . . 0.0 110.227 179.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.95 104.94 11.79 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.222 -0.924 . . . . 0.0 110.229 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.9 t -129.88 148.08 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.212 -0.93 . . . . 0.0 109.994 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.5 p -136.1 143.24 36.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.245 -0.909 . . . . 0.0 110.167 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -131.01 128.19 39.86 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.166 -0.959 . . . . 0.0 110.266 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -129.38 107.14 9.28 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.214 -0.929 . . . . 0.0 110.251 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -121.05 112.31 18.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.171 -0.955 . . . . 0.0 110.252 179.991 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.2 mt -125.43 132.96 52.63 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.236 -0.915 . . . . 0.0 110.228 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 36.6 p -130.7 115.84 17.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.191 -0.943 . . . . 0.0 110.212 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.8 m . . . . . 0 N--CA 1.494 1.751 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.144 -179.962 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 120.725 0.298 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.12 135.2 53.35 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.099 -1.001 . . . . 0.0 110.195 -179.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -123.32 72.07 1.1 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.187 -0.946 . . . . 0.0 110.237 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -122.46 139.59 53.7 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.159 -0.963 . . . . 0.0 110.117 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -141.97 135.18 29.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.178 -0.951 . . . . 0.0 110.228 -179.913 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.432 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.1 m-85 -118.37 137.55 53.04 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.212 -0.93 . . . . 0.0 110.127 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.7 m -122.78 159.47 27.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.186 -0.946 . . . . 0.0 109.295 179.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 25.8 m -130.08 116.17 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.038 -1.038 . . . . 0.0 110.311 179.577 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.16 151.82 37.66 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.999 -1.063 . . . . 0.0 110.298 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.452 ' OH ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -104.97 144.77 31.35 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.309 -0.87 . . . . 0.0 109.602 179.739 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.03 113.35 25.02 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.168 -0.957 . . . . 0.0 110.386 -179.762 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -113.48 -56.06 2.45 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.236 -0.915 . . . . 0.0 109.886 179.733 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.2 ttm-85 -125.52 39.02 4.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.178 -0.951 . . . . 0.0 110.133 179.768 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.12 155.06 25.94 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 t -146.59 146.03 30.3 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.286 -1.126 . . . . 0.0 110.279 179.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -156.08 149.01 24.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.193 -0.942 . . . . 0.0 111.589 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.96 125.88 41.02 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.09 140.9 56.57 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.309 -1.112 . . . . 0.0 110.361 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -88.99 153.8 20.72 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.944 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.36 33.01 22.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.84 -1.163 . . . . 0.0 109.664 -178.761 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 132.0 0.09 Allowed 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.772 -1.205 . . . . 0.0 109.372 -179.768 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.36 72.61 4.9 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.07 -1.019 . . . . 0.0 109.91 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -151.33 -175.52 5.21 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.247 -0.908 . . . . 0.0 110.318 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -133.38 156.83 46.95 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.914 -1.116 . . . . 0.0 109.756 -179.27 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.4 mt -105.03 114.95 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.344 -0.847 . . . . 0.0 109.617 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.9 t -110.61 160.93 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.21 -0.931 . . . . 0.0 110.3 -179.562 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -47.11 144.75 2.48 Favored 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.406 -0.809 . . . . 0.0 111.125 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 90.17 9.67 65.17 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.072 -1.061 . . . . 0.0 111.068 -179.35 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 8.5 p -125.1 133.95 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 119.485 1.642 . . . . 0.0 110.191 -179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.435 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 25.4 p -89.99 139.04 30.99 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.167 -0.958 . . . . 0.0 110.0 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.09 150.67 52.04 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.238 -0.913 . . . . 0.0 110.616 -179.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.407 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 20.5 mt -113.32 134.46 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.288 -0.883 . . . . 0.0 109.537 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.78 127.92 9.16 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.473 ' CB ' ' OH ' ' A' ' 51' ' ' TYR . 17.5 tttp -103.15 118.36 36.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.128 -1.219 . . . . 0.0 109.585 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 47.2 t -94.31 119.2 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.175 -0.953 . . . . 0.0 110.189 -179.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 63.0 t -116.44 111.94 41.67 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.201 -0.937 . . . . 0.0 109.698 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.04 140.96 32.15 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 O-C-N 123.123 1.065 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -103.69 150.89 38.6 Favored Pre-proline 0 N--CA 1.498 1.944 0 O-C-N 121.178 -0.951 . . . . 0.0 110.138 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.92 70.95 3.52 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.389 1.204 . . . . 0.0 110.277 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -147.07 -58.94 0.28 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.161 -0.962 . . . . 0.0 110.418 -179.935 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.3 t -113.96 156.04 24.75 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.123 -0.986 . . . . 0.0 110.247 179.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -102.36 -49.35 3.9 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.24 -0.913 . . . . 0.0 110.182 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.9 t -60.39 -40.43 90.85 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.205 -0.934 . . . . 0.0 110.049 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -133.46 -155.17 7.63 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.31 68.94 1.06 Allowed Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -143.13 143.64 31.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.168 -1.195 . . . . 0.0 110.227 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.1 ttp -114.85 124.15 51.0 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.208 -0.932 . . . . 0.0 110.25 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.415 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.2 OUTLIER -138.08 123.09 19.06 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.198 -0.939 . . . . 0.0 110.178 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -120.63 156.41 31.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.092 -1.005 . . . . 0.0 109.818 179.517 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.415 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 64.8 m95 -100.53 118.63 37.1 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.086 -1.009 . . . . 0.0 110.562 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.473 ' OH ' ' CB ' ' A' ' 34' ' ' LYS . 0.2 OUTLIER -132.58 163.26 29.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.182 -0.949 . . . . 0.0 110.282 178.301 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -58.5 -172.29 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.421 -0.8 . . . . 0.0 109.749 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.458 HG22 HD11 ' A' ' 53' ' ' ILE . 41.3 mm -88.12 -50.8 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.097 -1.002 . . . . 0.0 109.118 179.448 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.6 tttp -56.37 -28.33 58.85 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.347 -0.846 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.9 m -65.07 -39.08 92.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 120.856 -1.152 . . . . 0.0 110.251 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.2 tpt -80.31 -40.64 26.4 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.144 -0.973 . . . . 0.0 109.195 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -70.47 -29.29 65.81 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.369 -0.933 . . . . 0.0 109.901 178.526 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -65.96 -38.1 87.71 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.918 -1.114 . . . . 0.0 109.458 179.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -58.08 -37.79 75.15 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.116 -0.99 . . . . 0.0 109.938 179.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -69.34 -41.56 76.47 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 109.519 179.484 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -68.29 -34.56 76.39 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.267 -0.896 . . . . 0.0 110.234 179.465 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -37.09 33.81 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.065 -1.022 . . . . 0.0 110.284 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -128.3 142.63 51.08 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.013 -1.054 . . . . 0.0 110.093 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.71 101.56 9.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.164 -0.96 . . . . 0.0 110.216 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.95 3.46 53.04 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.222 -0.924 . . . . 0.0 112.011 179.497 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 55.56 36.76 27.82 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.381 -1.449 . . . . 0.0 110.45 -179.299 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.6 p -117.45 161.76 19.06 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.205 -0.934 . . . . 0.0 109.946 179.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.1 mmtp -97.45 95.38 7.61 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.172 -0.955 . . . . 0.0 109.971 179.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.8 mtmm -116.89 132.28 56.74 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.217 -0.927 . . . . 0.0 110.176 -179.979 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.416 HG22 HD11 ' A' ' 70' ' ' ILE . 79.5 mt 52.93 94.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 120.982 -1.074 . . . . 0.0 110.596 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -113.04 133.64 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.193 -0.942 . . . . 0.0 109.837 179.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t70 52.7 -163.91 0.08 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.002 -1.061 . . . . 0.0 110.466 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.426 HD21 ' OG1' ' A' ' 91' ' ' THR . 17.0 tp -110.64 -59.5 1.94 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 81.96 0.1 Allowed 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.131 -0.981 . . . . 0.0 109.343 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -166.27 -53.42 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.329 -0.857 . . . . 0.0 110.647 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 94.9 mt -62.38 150.94 38.28 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.262 -0.899 . . . . 0.0 109.462 179.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -78.8 118.23 20.66 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.137 -0.977 . . . . 0.0 110.516 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.65 -41.04 0.95 Allowed Glycine 0 N--CA 1.492 2.406 0 C-N-CA 119.646 -1.264 . . . . 0.0 110.942 179.313 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.426 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 30.1 p-90 -57.62 -28.78 63.98 Favored 'General case' 0 N--CA 1.512 2.669 0 CA-C-N 118.838 1.319 . . . . 0.0 111.157 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.426 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.1 tp10 -53.66 -27.63 28.6 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.819 -1.176 . . . . 0.0 111.462 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -109.42 24.33 13.24 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.717 -1.239 . . . . 0.0 112.302 -179.342 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 23.8 mt -111.79 -163.33 0.84 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.701 -1.249 . . . . 0.0 109.5 179.283 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -99.64 162.02 13.26 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.93 -1.106 . . . . 0.0 110.47 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.11 -46.98 26.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.263 -0.898 . . . . 0.0 110.08 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -61.52 -46.16 91.14 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.24 -0.913 . . . . 0.0 109.426 179.753 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.452 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 23.1 mt-10 -62.15 -39.91 94.21 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.274 179.095 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.6 mtmt -56.0 -37.97 69.84 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.201 -0.937 . . . . 0.0 109.763 179.006 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.41 -38.67 74.68 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.224 -0.923 . . . . 0.0 109.879 179.299 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -59.65 -40.73 88.65 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 109.88 179.634 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.2 mt -65.61 -38.29 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 121.317 -0.864 . . . . 0.0 109.399 179.312 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.426 ' OG1' HD21 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -60.52 -38.51 84.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.989 -1.069 . . . . 0.0 109.497 179.042 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -56.82 -38.14 72.18 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.224 -0.923 . . . . 0.0 109.873 179.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.425 ' CD2' HG23 ' A' ' 53' ' ' ILE . 2.7 m-70 -56.32 -51.39 68.39 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.092 -1.005 . . . . 0.0 109.777 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -62.29 -38.77 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.256 -0.903 . . . . 0.0 109.324 179.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.58 -40.95 89.17 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.204 -0.935 . . . . 0.0 109.526 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.19 -41.83 99.25 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.059 179.177 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.3 tp -76.26 -35.03 59.14 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.338 -0.851 . . . . 0.0 109.695 178.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.4 m -106.44 66.85 0.71 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.053 -1.029 . . . . 0.0 110.041 179.626 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.01 167.27 10.59 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.06 -1.025 . . . . 0.0 110.052 179.765 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -116.95 -177.79 3.28 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.221 -0.924 . . . . 0.0 110.458 -179.79 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -126.54 -163.69 1.26 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.315 -0.866 . . . . 0.0 110.006 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -109.59 93.46 4.52 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.134 -0.979 . . . . 0.0 110.148 179.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.03 137.57 9.75 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 7.3 t -140.98 147.55 48.36 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.167 -1.196 . . . . 0.0 110.249 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -74.14 -44.27 0.46 Allowed 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.343 1.181 . . . . 0.0 110.538 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.5 pttt -147.63 -172.75 4.11 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.209 -0.932 . . . . 0.0 110.512 -179.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 39.5 tttt -140.15 114.07 8.89 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.272 -0.892 . . . . 0.0 110.123 -179.981 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -126.29 48.36 2.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.154 -0.966 . . . . 0.0 110.212 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -128.8 107.65 9.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.17 -0.956 . . . . 0.0 110.21 -179.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.5 t -117.23 132.11 67.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.221 -0.925 . . . . 0.0 109.941 -179.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -126.25 125.64 68.02 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.243 -0.911 . . . . 0.0 110.009 179.945 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -129.14 145.92 51.19 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.25 -0.907 . . . . 0.0 110.279 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.48 107.28 9.6 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.251 -0.905 . . . . 0.0 110.249 -179.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -119.4 99.71 6.85 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.224 -0.922 . . . . 0.0 110.215 179.952 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.6 tp -119.99 146.8 45.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.237 -0.915 . . . . 0.0 110.272 179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 p -133.09 139.31 47.07 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.195 -0.94 . . . . 0.0 110.222 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 39.1 p . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.199 179.976 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ttp . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 120.7 0.286 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.91 178.71 5.36 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.182 -0.949 . . . . 0.0 110.206 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -126.6 -59.91 1.27 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.227 -0.921 . . . . 0.0 110.163 -180.0 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -135.05 143.93 46.99 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.314 -0.866 . . . . 0.0 110.201 179.985 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -115.97 152.47 33.42 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.195 -0.94 . . . . 0.0 110.301 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.528 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.6 OUTLIER -144.93 135.59 24.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.375 -0.828 . . . . 0.0 109.781 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 m -153.24 165.56 35.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.059 179.227 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.402 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 10.2 m -100.75 120.33 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.052 -1.03 . . . . 0.0 110.224 179.451 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.419 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 0.6 OUTLIER -115.15 99.29 7.32 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.102 -0.999 . . . . 0.0 110.099 179.838 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.45 ' OH ' ' CB ' ' A' ' 86' ' ' GLU . 40.3 m-85 -52.61 156.16 1.97 Allowed 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.144 -0.973 . . . . 0.0 110.427 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.26 112.66 24.65 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.39 -0.819 . . . . 0.0 110.332 -179.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -148.12 38.99 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.309 -0.87 . . . . 0.0 110.416 179.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 ttp85 -151.52 39.42 0.65 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.15 -0.969 . . . . 0.0 110.595 -179.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.84 -171.43 14.52 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 179.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 61.2 m -117.59 142.85 46.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.251 179.991 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.0 140.0 25.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.998 . . . . 0.0 110.91 -179.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.19 140.58 44.81 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 108.614 -1.795 . . . . 0.0 108.614 179.254 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.47 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 21.1 p -80.65 125.32 29.87 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.096 -1.238 . . . . 0.0 111.081 -178.882 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.454 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 156.99 38.0 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.839 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.54 16.15 10.37 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.813 -1.18 . . . . 0.0 111.411 -178.68 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.0 p -176.46 152.37 1.06 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.528 -1.357 . . . . 0.0 110.589 177.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 tptm -88.91 91.42 8.82 Favored 'General case' 0 N--CA 1.512 2.663 0 O-C-N 120.969 -1.082 . . . . 0.0 111.598 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.9 tt0 -168.35 -174.41 2.25 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.247 -0.908 . . . . 0.0 110.577 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.5 mttp -128.49 152.76 47.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.001 -1.062 . . . . 0.0 109.709 179.825 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 61.3 mt -107.75 98.85 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.222 -0.924 . . . . 0.0 109.959 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.1 t -105.08 160.58 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.33 -0.856 . . . . 0.0 110.006 179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -48.28 134.23 14.87 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 121.442 -0.786 . . . . 0.0 111.085 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.18 6.67 44.87 Favored Glycine 0 N--CA 1.495 2.58 0 C-N-CA 120.176 -1.011 . . . . 0.0 111.496 -179.734 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.4 p -125.59 137.49 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-N 119.681 1.741 . . . . 0.0 110.45 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 t -92.19 136.35 33.25 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.181 -0.949 . . . . 0.0 110.074 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 5.9 ptt-85 -135.27 149.14 49.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 179.928 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.413 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 15.6 mt -110.18 126.68 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.181 -0.949 . . . . 0.0 109.784 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.41 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.75 145.16 15.89 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.677 -1.769 . . . . 0.0 108.677 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 28.2 ttpt -111.95 125.08 53.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.192 -1.181 . . . . 0.0 109.057 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.7 t -100.26 109.58 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.072 -1.018 . . . . 0.0 110.506 -179.701 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.59 134.89 24.72 Favored Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.205 -0.934 . . . . 0.0 109.818 179.637 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.24 127.78 11.54 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.107 1.056 . . . . 0.0 110.207 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -104.05 116.79 60.95 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.146 -0.971 . . . . 0.0 110.186 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.93 80.84 2.32 Favored 'Trans proline' 0 C--N 1.32 -0.957 0 O-C-N 123.177 1.093 . . . . 0.0 110.312 179.788 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -145.68 -58.86 0.33 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.191 -0.943 . . . . 0.0 110.433 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.24 157.28 19.61 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.133 -0.979 . . . . 0.0 110.256 -179.867 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -96.23 -39.49 9.64 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.224 -0.923 . . . . 0.0 110.422 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 m -56.9 -39.75 75.01 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.01 -1.056 . . . . 0.0 110.186 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -77.59 -178.71 48.59 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -140.39 -88.36 0.15 Allowed Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -116.5 150.52 37.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.258 -1.143 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.3 mtt -111.99 147.39 36.04 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.234 -0.916 . . . . 0.0 110.203 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.0 ptpt -143.3 134.61 26.0 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.206 -0.934 . . . . 0.0 110.271 -179.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -112.15 159.57 18.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.754 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.419 ' CZ3' ' HB2' ' A' ' 9' ' ' ASP . 9.1 m95 -110.7 113.77 26.63 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.024 -1.047 . . . . 0.0 111.311 -179.729 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.528 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.4 OUTLIER -126.13 170.07 12.17 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.27 177.205 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.47 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 68.1 m80 -89.21 161.32 16.5 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.836 -0.746 . . . . 0.0 110.463 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.435 HG23 ' CG ' ' A' ' 93' ' ' HIS . 27.9 mt -65.53 -47.14 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.078 178.405 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.2 tttt -61.42 -40.73 95.49 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.279 -0.968 . . . . 0.0 109.214 178.609 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.3 m -63.92 -43.71 95.1 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.316 -0.865 . . . . 0.0 109.013 178.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.34 -45.58 54.28 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.431 -0.793 . . . . 0.0 109.775 179.938 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.421 ' CE2' HG22 ' A' ' 53' ' ' ILE . 10.6 m-85 -65.48 -28.81 69.47 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.618 179.033 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -64.47 -41.99 96.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.831 -1.168 . . . . 0.0 109.034 178.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.1 tptt -72.56 -41.44 65.76 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.375 -0.93 . . . . 0.0 108.702 178.399 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -39.95 94.11 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.529 -0.868 . . . . 0.0 108.857 178.62 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.05 -32.3 66.06 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.128 -0.982 . . . . 0.0 109.663 178.435 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -102.36 28.82 5.61 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.174 -0.954 . . . . 0.0 110.749 179.219 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.73 167.32 10.32 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.794 -1.191 . . . . 0.0 110.356 179.837 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -66.68 157.78 31.75 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.17 -0.956 . . . . 0.0 110.152 -179.876 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.2 -34.34 37.45 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.212 -0.93 . . . . 0.0 110.7 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.3 m -51.22 -34.42 32.02 Favored 'General case' 0 N--CA 1.514 2.773 0 O-C-N 120.96 -1.088 . . . . 0.0 110.941 -179.863 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -109.65 102.35 11.18 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.07 -1.019 . . . . 0.0 110.242 179.82 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -115.9 144.85 43.47 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.202 -0.937 . . . . 0.0 109.962 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mttp -125.7 149.38 48.54 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.133 -0.98 . . . . 0.0 110.605 -179.701 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.4 mt 54.35 101.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.258 -0.901 . . . . 0.0 111.093 179.851 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -112.22 146.65 37.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.319 -0.863 . . . . 0.0 109.014 178.826 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t0 53.81 -161.7 0.12 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.922 -1.111 . . . . 0.0 110.148 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.418 HD23 ' OG1' ' A' ' 91' ' ' THR . 4.8 tp -112.54 -60.0 1.93 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.952 -1.092 . . . . 0.0 110.614 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.406 HG21 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -72.72 73.36 1.08 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.162 -0.962 . . . . 0.0 109.925 -179.749 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -129.15 -58.35 1.14 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.19 -0.944 . . . . 0.0 110.309 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.414 ' N ' ' CD2' ' A' ' 76' ' ' LEU . 1.3 pt? -147.87 63.83 1.12 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.968 -1.083 . . . . 0.0 110.796 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.402 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 8.7 pt-20 -144.42 140.2 28.85 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.01 -1.056 . . . . 0.0 110.266 178.299 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.59 69.01 1.2 Allowed Glycine 0 N--CA 1.498 2.814 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.436 ' CE3' ' CE ' ' A' ' 87' ' ' LYS . 59.5 p-90 -92.49 -36.25 13.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.118 -1.224 . . . . 0.0 110.805 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -53.17 -28.92 28.86 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.057 -1.027 . . . . 0.0 111.363 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -96.38 -34.88 11.38 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.889 -1.132 . . . . 0.0 111.18 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.426 ' HB3' ' CD2' ' A' ' 10' ' ' TYR . 61.3 mt -74.7 -173.8 1.94 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.956 -1.09 . . . . 0.0 110.256 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.3 152.67 33.06 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.193 -0.942 . . . . 0.0 110.71 -179.399 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -89.78 -39.2 13.27 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.237 -0.914 . . . . 0.0 110.437 179.661 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.89 -44.25 86.59 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.046 -1.033 . . . . 0.0 109.971 -179.882 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.45 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 9.3 mt-10 -60.52 -39.81 89.17 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.444 179.175 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.436 ' CE ' ' CE3' ' A' ' 79' ' ' TRP . 0.3 OUTLIER -55.78 -38.19 69.57 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.904 179.182 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -41.66 90.15 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.865 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.45 -32.7 72.69 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.267 -0.896 . . . . 0.0 110.656 179.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 97.2 mt -65.12 -39.0 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 120.979 -1.076 . . . . 0.0 109.675 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.418 ' OG1' HD23 ' A' ' 73' ' ' LEU . 41.6 m -59.01 -39.09 80.82 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.964 -1.085 . . . . 0.0 109.892 179.649 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -56.32 -37.28 69.72 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.203 -0.936 . . . . 0.0 109.975 179.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.435 ' CG ' HG23 ' A' ' 53' ' ' ILE . 2.5 m-70 -57.46 -51.96 67.32 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.01 . . . . 0.0 110.008 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.3 mp -64.24 -38.62 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.31 179.642 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.66 81.43 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.203 -0.935 . . . . 0.0 109.741 179.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -66.57 -39.55 88.52 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.179 -0.951 . . . . 0.0 109.873 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -74.31 -34.73 63.57 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.281 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 74.8 m -96.53 58.09 1.69 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.027 -1.045 . . . . 0.0 110.094 179.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 90.9 p -136.34 39.77 2.67 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.131 -0.981 . . . . 0.0 110.253 179.934 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -140.45 99.92 3.76 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.116 -0.99 . . . . 0.0 110.212 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 52.69 81.22 0.09 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.014 -1.054 . . . . 0.0 110.918 -179.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.19 -172.19 2.26 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.189 -0.945 . . . . 0.0 110.201 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -107.58 156.58 15.83 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 19.5 p -141.04 94.86 7.72 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.19 -1.182 . . . . 0.0 110.237 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.81 76.38 2.47 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.425 1.224 . . . . 0.0 110.377 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -140.6 93.54 2.62 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.15 -0.969 . . . . 0.0 110.182 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -119.13 144.7 46.49 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.252 -0.905 . . . . 0.0 110.269 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -117.96 127.09 53.49 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.19 -0.944 . . . . 0.0 110.174 -179.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -120.74 167.01 12.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.183 -0.948 . . . . 0.0 110.195 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.74 127.15 73.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.21 -0.931 . . . . 0.0 109.913 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.7 t -115.94 120.71 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.151 -0.968 . . . . 0.0 110.087 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -117.03 128.29 55.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 110.142 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.53 136.35 53.31 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.187 -0.945 . . . . 0.0 110.311 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -121.47 128.33 52.0 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.24 -0.912 . . . . 0.0 110.13 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.88 152.89 32.53 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.187 -0.946 . . . . 0.0 110.157 -179.99 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 24.2 m -117.4 131.66 56.72 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.187 -0.946 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.168 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 mtt . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.83 123.19 15.87 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.142 -0.974 . . . . 0.0 110.28 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -136.24 145.25 45.41 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.178 -0.951 . . . . 0.0 110.227 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -138.08 133.59 33.66 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.146 -0.971 . . . . 0.0 110.215 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.99 151.51 36.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.25 -0.906 . . . . 0.0 110.215 -179.943 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.434 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.1 m-85 -149.27 136.45 19.93 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.304 -0.873 . . . . 0.0 110.205 -179.65 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 76' ' ' LEU . 26.2 p -151.93 157.66 42.1 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.227 -0.921 . . . . 0.0 109.807 178.735 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -102.3 141.44 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.834 -1.166 . . . . 0.0 110.798 179.869 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -141.97 148.24 38.27 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.269 -0.894 . . . . 0.0 109.607 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.422 ' CD2' HD12 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -96.02 151.61 19.29 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.085 -1.01 . . . . 0.0 109.873 179.917 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -92.95 147.14 23.09 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.289 -0.882 . . . . 0.0 110.546 -179.578 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -120.1 -57.83 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.29 -0.881 . . . . 0.0 110.056 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -139.29 132.54 29.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.184 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.15 164.67 14.49 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 179.898 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.9 m -135.0 143.71 46.97 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -1.159 . . . . 0.0 110.258 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.32 143.82 34.26 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.222 -0.924 . . . . 0.0 110.884 -179.85 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.05 127.87 13.46 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.09 130.39 44.45 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.358 -1.084 . . . . 0.0 109.381 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.423 ' HB3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -61.92 147.86 45.45 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 109.212 179.793 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 mttt 52.6 45.41 28.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.905 -1.122 . . . . 0.0 109.591 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 31.6 t -164.89 144.72 7.14 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.386 -0.821 . . . . 0.0 110.769 -178.156 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.75 56.71 1.29 Allowed 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -145.63 -172.05 3.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.374 -0.829 . . . . 0.0 110.238 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -135.31 159.29 42.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.193 -0.942 . . . . 0.0 109.629 -179.6 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 74.3 mt -107.92 119.36 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.41 -0.806 . . . . 0.0 110.057 -179.781 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 32.4 m -118.7 166.2 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.202 -0.936 . . . . 0.0 110.584 -179.845 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -48.13 143.28 4.57 Favored 'General case' 0 N--CA 1.515 2.784 0 O-C-N 121.512 -0.742 . . . . 0.0 111.023 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 96.3 5.83 59.07 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.15 -1.024 . . . . 0.0 111.239 -179.362 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 7.1 p -126.89 133.63 68.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 119.545 1.673 . . . . 0.0 109.977 179.796 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 43.2 t -81.13 139.31 35.69 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.052 -1.03 . . . . 0.0 109.341 179.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 7.8 mtp180 -124.21 142.9 50.85 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.176 -0.952 . . . . 0.0 110.697 -178.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 22.9 mt -96.74 129.01 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.105 -0.997 . . . . 0.0 109.375 178.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.9 122.72 7.7 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.434 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 58.4 tttt -106.25 122.07 45.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.217 -1.166 . . . . 0.0 109.703 -179.79 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -101.0 115.54 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.996 . . . . 0.0 110.361 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.2 t -120.73 111.67 34.33 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.214 -0.929 . . . . 0.0 109.762 179.826 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.08 131.01 14.91 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.131 1.069 . . . . 0.0 110.431 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -103.98 117.13 60.34 Favored Pre-proline 0 N--CA 1.501 2.076 0 O-C-N 121.231 -0.918 . . . . 0.0 110.035 179.734 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.53 70.62 4.87 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 O-C-N 123.207 1.109 . . . . 0.0 110.39 179.813 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -147.67 -59.14 0.26 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.071 -1.018 . . . . 0.0 110.482 -179.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 m -109.42 157.94 18.43 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.157 -0.964 . . . . 0.0 110.278 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -94.58 -38.89 10.65 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.291 -0.881 . . . . 0.0 110.331 179.854 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.26 -40.07 76.9 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.051 -1.03 . . . . 0.0 110.118 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.43 84.28 0.9 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.85 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.69 -74.1 0.43 Allowed Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 -179.807 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -133.47 151.17 51.75 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.216 -1.167 . . . . 0.0 110.466 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttt -110.91 142.8 42.49 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.337 -0.852 . . . . 0.0 110.019 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.412 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -119.6 124.84 47.34 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.166 -0.959 . . . . 0.0 110.328 -179.769 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -112.15 146.88 37.26 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.142 -0.974 . . . . 0.0 109.627 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.412 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 18.0 m95 -98.88 128.17 44.99 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.181 -0.95 . . . . 0.0 110.281 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.423 ' CE2' ' HB3' ' A' ' 19' ' ' LYS . 86.9 m-85 -111.56 172.8 6.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -90.25 -173.09 3.7 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.534 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.507 HG23 ' NE2' ' A' ' 93' ' ' HIS . 40.5 mm -87.28 -38.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.005 -1.06 . . . . 0.0 109.332 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -88.13 -29.33 20.66 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.73 -1.231 . . . . 0.0 110.915 179.116 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.6 m -65.9 -51.66 56.71 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.835 -1.166 . . . . 0.0 110.487 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.6 tpt -66.59 -39.75 88.56 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.178 -179.509 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.431 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 6.7 m-85 -72.87 -30.56 64.08 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.792 179.191 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -67.75 -36.71 81.03 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.918 -1.114 . . . . 0.0 109.639 178.784 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -39.87 86.73 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.045 -1.034 . . . . 0.0 109.82 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -59.08 -43.39 91.8 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.248 179.351 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -57.82 -34.67 69.92 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.194 -0.941 . . . . 0.0 109.484 178.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 6.9 ttm105 -103.78 30.77 4.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.399 179.037 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -102.37 170.28 8.16 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.917 -1.115 . . . . 0.0 109.945 179.643 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.402 ' O ' ' OG1' ' A' ' 67' ' ' THR . 4.7 mmm180 -60.71 155.59 18.81 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.156 -0.965 . . . . 0.0 110.069 -179.678 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.79 -33.64 76.47 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.227 -0.921 . . . . 0.0 110.804 -179.79 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 41.7 p -96.96 58.26 1.58 Allowed 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.935 -1.103 . . . . 0.0 110.229 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 64' ' ' ARG . 3.2 m -115.95 157.94 23.81 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.183 -0.948 . . . . 0.0 110.105 179.841 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -136.02 100.49 4.44 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.203 -0.936 . . . . 0.0 110.193 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.05 108.83 5.95 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.235 -0.915 . . . . 0.0 110.277 -179.876 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.401 HD11 HG22 ' A' ' 70' ' ' ILE . 78.9 mt 54.28 99.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.163 -0.961 . . . . 0.0 110.838 179.846 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -112.79 134.86 54.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.209 -0.932 . . . . 0.0 109.647 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 t70 53.74 -165.18 0.09 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.964 -1.085 . . . . 0.0 110.451 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -114.26 -176.97 3.02 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.103 -0.998 . . . . 0.0 110.218 179.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.414 HG23 ' CZ2' ' A' ' 79' ' ' TRP . 0.5 OUTLIER 46.73 37.3 4.54 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.154 -0.966 . . . . 0.0 111.425 -179.777 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -111.45 -60.05 1.9 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.599 179.547 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.409 HD13 ' CB ' ' A' ' 6' ' ' PHE . 1.1 pt? -143.42 62.3 1.38 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.214 -0.929 . . . . 0.0 109.772 178.681 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.41 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 12.8 pt-20 -144.92 141.26 28.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.754 -1.216 . . . . 0.0 111.002 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.02 70.12 1.24 Allowed Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.806 -1.718 . . . . 0.0 108.806 178.859 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.414 ' CZ2' HG23 ' A' ' 74' ' ' THR . 60.7 p-90 -90.7 -23.55 20.69 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.313 -1.11 . . . . 0.0 111.787 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -51.77 -32.0 29.15 Favored 'General case' 0 N--CA 1.514 2.756 0 O-C-N 120.702 -1.248 . . . . 0.0 110.768 179.741 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -83.48 -38.6 21.61 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.917 -1.115 . . . . 0.0 109.892 179.243 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.422 HD12 ' CD2' ' A' ' 10' ' ' TYR . 0.2 OUTLIER -51.76 178.63 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.84 0 O-C-N 121.062 -1.024 . . . . 0.0 110.508 -179.925 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -105.68 160.85 14.89 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.127 -0.983 . . . . 0.0 110.415 179.872 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -58.72 -39.79 81.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.272 -0.892 . . . . 0.0 110.403 -179.646 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -66.38 -42.41 87.99 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.249 -0.907 . . . . 0.0 109.705 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 20.3 mt-10 -66.63 -39.29 88.24 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.513 -0.875 . . . . 0.0 109.416 179.234 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 16.2 ttpp -61.38 -39.08 89.35 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.843 179.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 13.6 tt0 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.165 -0.96 . . . . 0.0 110.063 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -63.8 -39.29 93.89 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.151 -0.968 . . . . 0.0 110.083 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 8.3 mt -67.17 -41.15 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.417 0 O-C-N 121.216 -0.928 . . . . 0.0 109.379 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 30.5 p -60.83 -38.32 85.08 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.166 -0.959 . . . . 0.0 109.802 179.437 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -57.6 -39.89 77.84 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.113 -0.992 . . . . 0.0 109.845 179.533 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.507 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.8 m-70 -60.2 -52.99 62.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.19 -0.943 . . . . 0.0 109.702 179.651 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.431 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 7.9 mt -63.28 -39.21 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 C-N-CA 119.352 -0.939 . . . . 0.0 109.414 179.46 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.02 -41.14 91.37 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.179 -0.95 . . . . 0.0 109.219 178.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -71.07 -42.6 69.19 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.201 -0.937 . . . . 0.0 108.703 178.731 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.5 tp -62.53 -34.11 76.25 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.323 -0.861 . . . . 0.0 109.974 178.94 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.4 t -96.92 52.66 1.18 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.115 -0.991 . . . . 0.0 110.165 179.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 t -133.07 116.15 15.99 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.91 -64.11 1.36 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.202 -0.936 . . . . 0.0 110.191 -179.885 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -117.09 136.58 52.88 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.234 -0.916 . . . . 0.0 110.238 -179.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.76 118.61 20.17 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.294 -0.879 . . . . 0.0 110.21 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.46 154.23 42.21 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 4.2 p -116.68 138.45 24.56 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.174 -1.192 . . . . 0.0 110.121 179.993 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -74.31 153.37 45.42 Favored 'Trans proline' 0 C--N 1.318 -1.033 0 O-C-N 123.311 1.164 . . . . 0.0 110.42 -179.97 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -127.89 85.75 2.39 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.202 -0.936 . . . . 0.0 110.065 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? 52.84 60.22 3.93 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.041 -1.037 . . . . 0.0 110.644 -179.971 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -116.24 -175.58 2.78 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.22 -0.925 . . . . 0.0 110.181 -179.98 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.2 106.05 11.15 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.122 -0.986 . . . . 0.0 110.199 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.8 t -128.35 117.72 46.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.104 -0.998 . . . . 0.0 109.933 179.956 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.4 t -124.66 136.16 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.171 -0.955 . . . . 0.0 109.993 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -125.87 113.21 16.92 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.289 -0.882 . . . . 0.0 110.21 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -120.93 100.72 7.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.165 -0.96 . . . . 0.0 110.189 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.81 150.93 47.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.246 -0.909 . . . . 0.0 110.331 179.803 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.7 mt -126.12 150.19 48.4 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.197 -0.94 . . . . 0.0 110.312 -179.889 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 40.8 p -118.79 134.48 55.11 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.187 -0.946 . . . . 0.0 110.199 179.982 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.6 p . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.244 -179.989 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.06 -177.98 5.07 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.258 -0.901 . . . . 0.0 110.272 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -123.5 78.56 1.6 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.251 -0.906 . . . . 0.0 110.155 179.972 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -125.71 158.78 33.95 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.143 -0.973 . . . . 0.0 110.199 -179.96 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.7 156.67 37.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.179 -0.95 . . . . 0.0 110.395 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.511 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -147.34 136.63 22.54 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.423 -0.798 . . . . 0.0 109.915 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.3 p -152.83 160.93 43.11 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 110.027 178.957 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.423 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 6.8 m -101.98 122.57 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 120.926 -1.109 . . . . 0.0 110.612 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.71 154.99 34.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.103 -0.998 . . . . 0.0 110.223 179.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.53 149.48 27.09 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.487 -0.758 . . . . 0.0 110.075 -179.798 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -111.16 126.29 54.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.244 -0.91 . . . . 0.0 110.127 179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -116.61 -56.18 2.3 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.262 -0.899 . . . . 0.0 110.277 -179.916 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -117.39 93.18 4.07 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.156 -0.965 . . . . 0.0 110.307 -179.966 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.44 126.74 2.29 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.2 p -115.58 145.59 42.53 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.202 -1.175 . . . . 0.0 110.07 179.881 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.92 145.54 28.66 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.195 -0.941 . . . . 0.0 110.879 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.34 130.44 47.7 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . 0.431 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 31.1 p -69.6 117.13 10.82 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.28 -1.129 . . . . 0.0 111.014 -178.722 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 11.8 mmtt -64.59 157.28 27.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.15 -0.969 . . . . 0.0 109.547 179.849 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.52 18.42 11.05 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.519 -1.363 . . . . 0.0 111.395 -178.909 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.2 p -175.18 143.65 0.69 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.576 -1.328 . . . . 0.0 110.663 178.13 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.87 84.69 7.3 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.017 -1.052 . . . . 0.0 111.914 -177.861 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -163.6 -174.71 3.83 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 178.687 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.4 ttmm -129.69 156.57 44.04 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.002 -1.061 . . . . 0.0 109.983 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.4 mt -109.14 129.53 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 33.3 m -125.17 160.39 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.174 -0.954 . . . . 0.0 110.238 179.873 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -46.29 134.67 8.62 Favored 'General case' 0 N--CA 1.518 2.931 0 O-C-N 121.43 -0.794 . . . . 0.0 111.452 -179.321 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.43 10.39 44.66 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.386 -179.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 9.8 p -125.53 135.9 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 CA-C-N 119.667 1.733 . . . . 0.0 110.424 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 45.1 t -92.24 130.28 37.98 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.192 -0.943 . . . . 0.0 109.511 179.26 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.26 150.85 46.67 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.233 -0.917 . . . . 0.0 110.538 -179.693 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 32' ' ' ILE . 22.1 mt -101.65 129.12 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.275 -0.891 . . . . 0.0 109.644 179.747 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.423 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.63 129.67 9.93 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.258 -1.537 . . . . 0.0 109.258 179.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 11.4 ttpt -101.85 121.26 41.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.302 -1.116 . . . . 0.0 109.066 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 56.0 t -102.71 110.51 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.022 -1.049 . . . . 0.0 110.552 -179.446 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.5 t -121.32 112.09 33.15 Favored Pre-proline 0 N--CA 1.496 1.855 0 O-C-N 121.265 -0.897 . . . . 0.0 109.568 179.612 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.26 126.49 11.11 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.116 1.061 . . . . 0.0 110.451 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -105.2 115.74 61.67 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 121.252 -0.905 . . . . 0.0 110.183 179.671 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -78.2 80.87 2.88 Favored 'Trans proline' 0 C--N 1.321 -0.905 0 O-C-N 123.125 1.066 . . . . 0.0 110.299 179.66 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -152.76 -57.7 0.13 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.046 -1.034 . . . . 0.0 110.86 -179.72 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.0 p -99.55 157.86 16.15 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.106 -0.996 . . . . 0.0 110.338 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -96.27 -41.72 8.52 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.205 -0.935 . . . . 0.0 110.317 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -56.27 -39.7 73.06 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.128 -0.982 . . . . 0.0 110.233 -179.922 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -94.97 155.33 21.48 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 179.729 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.95 -72.81 0.1 OUTLIER Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.957 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.51 148.4 37.96 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.21 -1.171 . . . . 0.0 110.105 -179.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.9 mtt -114.99 119.78 37.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.293 -0.879 . . . . 0.0 110.274 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 26.3 ttmt -116.1 127.96 55.28 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.208 -0.932 . . . . 0.0 109.988 179.829 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -114.59 124.99 53.24 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.423 ' CZ3' ' HA2' ' A' ' 33' ' ' GLY . 17.6 m95 -89.01 126.69 35.53 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.187 -0.946 . . . . 0.0 110.057 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.511 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 1.0 OUTLIER -147.21 170.46 17.2 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.527 178.68 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.431 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 57.1 m80 -74.72 179.69 4.64 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.658 -0.651 . . . . 0.0 111.217 -178.414 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.437 HG23 ' CD2' ' A' ' 93' ' ' HIS . 33.6 mm -88.57 -48.92 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 179.044 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -60.46 -38.6 84.71 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.342 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.1 m -61.69 -50.01 74.21 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.238 -0.914 . . . . 0.0 109.068 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.4 tpt -68.91 -45.49 70.76 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.729 -0.789 . . . . 0.0 109.385 179.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.415 ' CD1' HG21 ' A' ' 53' ' ' ILE . 8.9 m-85 -63.95 -30.47 71.55 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.615 178.926 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -60.43 -39.79 88.74 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.883 -1.136 . . . . 0.0 109.62 179.143 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.408 179.251 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -59.83 -42.61 93.91 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.126 -0.984 . . . . 0.0 109.173 179.23 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -58.51 -34.49 71.01 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.229 -0.92 . . . . 0.0 109.661 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -105.42 30.19 5.88 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.208 -0.932 . . . . 0.0 110.723 179.261 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -113.11 167.26 10.69 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 110.104 179.854 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.07 156.28 28.72 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.113 -0.992 . . . . 0.0 110.083 -179.853 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.32 -34.21 21.91 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.197 -0.939 . . . . 0.0 110.584 179.802 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.1 -35.89 37.54 Favored 'General case' 0 N--CA 1.514 2.757 0 O-C-N 120.896 -1.128 . . . . 0.0 110.872 -179.84 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.9 p -107.9 118.6 37.16 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.1 -1.0 . . . . 0.0 110.028 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -115.85 143.96 44.69 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.149 -0.97 . . . . 0.0 110.296 -179.949 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.01 139.42 53.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.242 -0.911 . . . . 0.0 110.055 -179.991 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.07 98.25 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.232 -0.917 . . . . 0.0 110.689 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -109.51 134.63 51.66 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.228 -0.92 . . . . 0.0 109.544 179.339 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 54.37 -165.36 0.1 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.956 -1.09 . . . . 0.0 110.203 -179.534 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.4 ' C ' ' OG1' ' A' ' 74' ' ' THR . 0.3 OUTLIER -116.16 -172.41 2.17 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.122 -0.986 . . . . 0.0 110.201 179.872 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.421 HG23 ' CZ2' ' A' ' 79' ' ' TRP . 0.7 OUTLIER 46.9 37.1 4.51 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.114 -0.992 . . . . 0.0 111.296 -179.577 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -109.81 -58.3 2.07 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.153 -0.967 . . . . 0.0 109.652 179.579 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.417 ' O ' ' HG ' ' A' ' 76' ' ' LEU . 1.2 pt? -145.23 62.2 1.29 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.093 -1.004 . . . . 0.0 109.861 178.668 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.423 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 12.4 pt-20 -143.92 140.82 29.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.8 -1.188 . . . . 0.0 110.867 179.321 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.77 70.27 0.95 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.421 ' CZ2' HG23 ' A' ' 74' ' ' THR . 61.8 p-90 -90.58 -23.4 20.86 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.23 -1.159 . . . . 0.0 111.644 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -52.47 -34.41 48.94 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.685 -1.259 . . . . 0.0 110.285 179.45 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.68 -39.03 20.71 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.088 -1.007 . . . . 0.0 109.635 178.972 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.421 HD13 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -51.12 177.21 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.046 -1.034 . . . . 0.0 110.42 179.787 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -101.31 160.56 14.31 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.137 -0.977 . . . . 0.0 110.413 179.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.7 -42.9 98.12 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.26 -0.9 . . . . 0.0 110.101 -179.888 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.69 -41.8 99.3 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.539 -0.865 . . . . 0.0 109.751 179.839 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.42 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 71.4 mt-10 -67.52 -40.56 85.1 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.523 -0.871 . . . . 0.0 109.253 179.109 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -61.3 -38.91 88.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.305 -0.872 . . . . 0.0 109.814 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.41 ' O ' ' OG1' ' A' ' 91' ' ' THR . 18.2 mm-40 -58.77 -39.75 81.93 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.258 -0.901 . . . . 0.0 109.922 179.743 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -60.52 -35.73 76.68 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.152 -0.967 . . . . 0.0 110.362 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.467 HD11 HG22 ' A' ' 90' ' ' ILE . 47.7 mm -69.28 -39.2 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.084 -1.01 . . . . 0.0 109.371 179.561 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 73.5 p -61.31 -39.18 89.52 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.023 -1.048 . . . . 0.0 109.603 179.257 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -57.61 -36.85 72.32 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.153 -0.967 . . . . 0.0 109.906 179.226 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.437 ' CD2' HG23 ' A' ' 53' ' ' ILE . 12.7 m-70 -59.37 -53.43 58.29 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.127 -0.983 . . . . 0.0 109.878 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.4 mp -63.29 -38.55 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.435 179.616 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.409 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -69.4 -37.24 77.42 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.182 -0.949 . . . . 0.0 109.9 179.198 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.73 -38.4 73.56 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.13 -0.981 . . . . 0.0 109.712 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -78.9 -32.75 45.91 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.116 -0.99 . . . . 0.0 110.315 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.8 t -96.01 54.03 1.43 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.98 -1.075 . . . . 0.0 110.193 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.409 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 5.0 m -120.93 40.22 3.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.126 -0.984 . . . . 0.0 110.227 179.859 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -136.54 134.38 37.45 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.193 -0.942 . . . . 0.0 110.213 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -135.14 102.03 5.06 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.228 -0.92 . . . . 0.0 110.217 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.0 54.76 1.73 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.208 -0.932 . . . . 0.0 110.238 179.971 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 72.65 79.19 0.48 Allowed Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.0 p -125.69 150.38 68.2 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.291 -1.123 . . . . 0.0 110.275 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.76 175.72 9.91 Favored 'Trans proline' 0 C--N 1.317 -1.103 0 O-C-N 123.487 1.256 . . . . 0.0 110.434 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.3 mtmt -129.8 72.35 1.48 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.206 -0.934 . . . . 0.0 110.212 -179.919 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.0 tttt 52.38 38.97 26.54 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.979 -1.076 . . . . 0.0 110.758 -179.916 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -142.45 126.83 17.7 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.222 -0.924 . . . . 0.0 110.205 -179.953 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -119.92 104.88 10.55 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.171 -0.956 . . . . 0.0 110.225 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.3 t -130.12 99.99 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.308 -0.87 . . . . 0.0 109.968 179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.17 143.12 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.263 -0.898 . . . . 0.0 110.276 -179.936 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -129.49 90.38 2.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.237 -0.914 . . . . 0.0 110.247 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.75 123.13 44.08 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.15 -0.969 . . . . 0.0 110.236 -179.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -123.57 102.37 7.82 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.168 -0.958 . . . . 0.0 110.288 179.927 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 8.2 tp -122.4 111.97 17.51 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.191 -0.943 . . . . 0.0 110.158 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.5 t -141.84 146.87 36.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.193 -0.942 . . . . 0.0 110.319 -179.971 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.501 2.112 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.782 179.992 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.3 mtp . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -122.78 175.54 6.48 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.162 -0.961 . . . . 0.0 110.183 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -146.12 85.97 1.69 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.18 -0.95 . . . . 0.0 110.503 -179.897 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -117.88 159.38 23.2 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.169 -0.957 . . . . 0.0 110.019 179.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.22 145.04 51.05 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.948 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 34' ' ' LYS . 0.3 OUTLIER -150.24 137.6 19.66 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.286 -0.884 . . . . 0.0 109.726 -179.94 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -153.3 157.03 39.5 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.157 -0.964 . . . . 0.0 110.258 179.193 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 5.7 m -100.98 135.09 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.308 0 O-C-N 121.004 -1.06 . . . . 0.0 110.505 179.637 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.52 157.71 46.21 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.335 -0.853 . . . . 0.0 110.133 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.425 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -107.17 154.91 20.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.407 -0.808 . . . . 0.0 110.085 -179.958 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.97 133.07 37.79 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.319 -0.863 . . . . 0.0 110.061 179.76 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 -55.44 2.44 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.27 -0.894 . . . . 0.0 110.456 -179.805 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 -138.51 105.87 5.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.166 -0.959 . . . . 0.0 110.29 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.75 151.56 6.04 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 83.8 m -116.11 142.23 47.09 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.226 -1.161 . . . . 0.0 110.033 179.897 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.23 129.74 27.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.141 -0.974 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.77 122.19 25.56 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -61.24 129.91 43.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -1.151 . . . . 0.0 109.441 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 14.9 tptt -61.98 147.42 47.05 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.168 179.827 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt 52.29 48.45 22.63 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.05 -1.031 . . . . 0.0 109.776 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.5 t -164.43 155.75 15.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.342 -0.849 . . . . 0.0 110.736 -178.147 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.87 44.25 1.04 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.27 -0.894 . . . . 0.0 108.604 178.629 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.35 -174.65 4.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.447 -0.783 . . . . 0.0 110.198 -179.045 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -136.46 156.62 48.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.091 -1.006 . . . . 0.0 109.743 -179.516 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 49.4 mt -97.58 121.56 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.645 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.1 m -129.51 176.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.331 -0.855 . . . . 0.0 110.6 -179.514 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -43.64 125.88 4.26 Favored 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.784 -0.573 . . . . 0.0 111.334 -179.544 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.16 8.58 50.2 Favored Glycine 0 N--CA 1.492 2.417 0 C-N-CA 120.151 -1.023 . . . . 0.0 110.955 -179.212 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 54.9 t -122.07 134.45 65.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-N 119.562 1.681 . . . . 0.0 109.869 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 51.4 t -96.36 138.03 34.56 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.25 -0.906 . . . . 0.0 108.64 178.516 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.439 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 4.9 ptt85 -136.05 151.05 49.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.128 -0.982 . . . . 0.0 111.151 -178.924 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 20.5 mt -105.01 137.0 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.26 -0.9 . . . . 0.0 109.832 179.873 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -107.13 127.16 8.7 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 108.934 -1.666 . . . . 0.0 108.934 179.658 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.448 ' CE ' ' OH ' ' A' ' 51' ' ' TYR . 49.6 pttt -110.89 124.05 51.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.154 -1.203 . . . . 0.0 110.08 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -112.72 107.99 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.918 -1.114 . . . . 0.0 110.121 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -122.39 112.23 31.38 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.225 -0.922 . . . . 0.0 109.919 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.74 127.19 12.08 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.198 1.104 . . . . 0.0 110.206 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -104.18 118.85 55.91 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 121.112 -0.992 . . . . 0.0 110.162 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.23 71.45 2.97 Favored 'Trans proline' 0 N--CA 1.484 0.939 0 O-C-N 123.133 1.07 . . . . 0.0 110.304 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -145.87 -58.77 0.32 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.184 -0.947 . . . . 0.0 110.427 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 t -108.1 157.42 18.29 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.076 -1.015 . . . . 0.0 110.222 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -95.65 -39.09 10.08 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.26 -0.9 . . . . 0.0 110.36 -179.98 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -39.62 76.48 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.09 -1.007 . . . . 0.0 110.243 -179.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -108.04 81.31 0.29 Allowed Glycine 0 N--CA 1.493 2.499 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.937 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -73.63 -69.38 1.4 Allowed Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.49 133.88 55.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.148 -1.207 . . . . 0.0 110.256 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 37.5 mtt -117.52 138.49 51.86 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.169 -0.957 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 ttmm -117.23 125.77 51.69 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.187 -0.945 . . . . 0.0 109.996 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -114.81 134.6 54.99 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.181 -0.95 . . . . 0.0 109.946 179.91 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.439 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 42.2 m95 -93.09 126.93 38.43 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.31 -0.869 . . . . 0.0 109.655 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.448 ' OH ' ' CE ' ' A' ' 34' ' ' LYS . 98.1 m-85 -112.2 174.66 5.77 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.289 -0.882 . . . . 0.0 110.616 -179.477 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -92.64 -172.35 3.02 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.473 HG23 ' NE2' ' A' ' 93' ' ' HIS . 35.2 mm -83.74 -41.62 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.928 178.828 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -89.13 -24.29 22.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.01 -1.056 . . . . 0.0 111.384 179.164 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 60.8 m -75.8 -41.44 52.81 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.638 -1.289 . . . . 0.0 110.198 -179.946 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -36.24 67.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.399 -0.92 . . . . 0.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.427 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 11.2 m-85 -80.89 -31.69 35.13 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 119.024 -1.07 . . . . 0.0 109.737 179.089 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -78.79 -33.42 46.28 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.032 -1.042 . . . . 0.0 109.677 178.153 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.95 -33.39 65.88 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.028 -1.045 . . . . 0.0 109.979 179.224 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 tp -75.24 -40.15 59.25 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.033 -1.042 . . . . 0.0 109.443 179.291 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -73.5 -30.28 63.03 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.219 -0.925 . . . . 0.0 110.324 178.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.75 -30.47 14.24 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.036 -1.04 . . . . 0.0 111.003 179.918 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -121.95 106.57 11.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.907 -1.121 . . . . 0.0 110.429 -179.567 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.5 ttp-105 -119.84 102.74 8.79 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.247 -0.908 . . . . 0.0 110.241 179.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.15 -35.97 15.95 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.145 -0.972 . . . . 0.0 110.424 179.66 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.1 p -131.38 -168.04 1.95 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.102 -0.999 . . . . 0.0 109.625 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -86.6 98.46 11.1 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.983 -1.073 . . . . 0.0 109.722 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.412 ' HE3' ' CE2' ' A' ' 6' ' ' PHE . 17.1 ttpt -143.96 113.72 7.16 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.289 -0.882 . . . . 0.0 110.108 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.5 tptm -140.34 138.33 34.79 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.214 -0.929 . . . . 0.0 110.556 -179.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.5 mt -112.51 113.83 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.292 -0.88 . . . . 0.0 109.66 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -110.48 155.04 22.79 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.185 -0.947 . . . . 0.0 110.391 -179.777 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 50.95 -175.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.06 -1.025 . . . . 0.0 110.897 -179.983 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.2 tp -125.61 37.92 4.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.281 -0.887 . . . . 0.0 110.575 -179.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.425 HG23 ' CZ2' ' A' ' 79' ' ' TRP . 0.6 OUTLIER -145.64 39.19 1.15 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.189 -0.945 . . . . 0.0 110.306 179.661 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -109.75 -58.61 2.03 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.204 -0.935 . . . . 0.0 109.581 179.452 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.411 ' N ' ' CD2' ' A' ' 76' ' ' LEU . 1.3 pt? -145.28 62.69 1.29 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.235 -0.916 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.416 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 0.7 OUTLIER -145.86 141.0 27.45 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.902 -1.124 . . . . 0.0 111.062 179.394 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.89 69.24 2.45 Favored Glycine 0 N--CA 1.496 2.675 0 N-CA-C 108.943 -1.663 . . . . 0.0 108.943 179.227 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.425 ' CZ2' HG23 ' A' ' 74' ' ' THR . 61.7 p-90 -89.08 -23.49 22.51 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.248 -1.148 . . . . 0.0 111.783 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -52.12 -33.55 40.41 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.581 -1.324 . . . . 0.0 110.692 179.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.73 -38.43 28.77 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.953 -1.092 . . . . 0.0 109.817 179.173 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.403 ' CD2' ' CD1' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -50.88 177.58 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.139 -0.976 . . . . 0.0 110.686 -179.991 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -102.75 160.45 14.58 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.122 -0.986 . . . . 0.0 110.355 179.823 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -60.94 -43.5 98.6 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.259 -0.9 . . . . 0.0 110.177 -179.819 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -61.27 -50.57 72.49 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.27 -0.893 . . . . 0.0 109.56 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.425 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 1.2 mp0 -62.92 -41.04 99.34 Favored 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.157 178.975 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 1.3 ttpm? -60.09 -38.46 82.98 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.35 -0.844 . . . . 0.0 110.005 179.324 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.84 -39.14 93.09 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.227 -0.92 . . . . 0.0 110.065 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -39.82 87.69 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.103 -0.998 . . . . 0.0 110.006 179.791 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . 0.403 ' CD1' ' CD2' ' A' ' 82' ' ' LEU . 13.6 mt -66.13 -39.73 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.197 -0.939 . . . . 0.0 109.395 179.45 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.49 -37.9 79.46 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.171 -0.956 . . . . 0.0 109.955 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -58.29 -39.86 80.41 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.194 -0.942 . . . . 0.0 109.814 179.454 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.473 ' NE2' HG23 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.84 -50.83 72.52 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.178 -0.951 . . . . 0.0 110.076 179.813 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.427 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 4.1 mt -58.88 -38.4 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.18 -0.95 . . . . 0.0 110.015 179.851 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.65 -38.89 86.32 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.164 -0.96 . . . . 0.0 109.681 179.276 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -59.81 -46.2 89.98 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.168 -0.958 . . . . 0.0 109.596 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.4 mp -57.21 -34.26 68.36 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.116 -0.99 . . . . 0.0 110.381 179.589 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.2 m -97.93 51.41 1.04 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.03 -1.044 . . . . 0.0 110.095 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.1 p -142.28 120.33 12.11 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.945 . . . . 0.0 110.1 179.926 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? 53.16 72.1 0.45 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.052 -1.03 . . . . 0.0 110.766 -179.863 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -117.35 -57.08 2.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.126 -0.984 . . . . 0.0 110.286 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -115.67 155.86 26.95 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.181 -0.949 . . . . 0.0 110.174 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -82.26 153.34 32.02 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.891 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.06 96.45 49.33 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.246 -1.149 . . . . 0.0 110.209 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.27 74.65 2.5 Favored 'Trans proline' 0 C--N 1.316 -1.135 0 O-C-N 123.421 1.221 . . . . 0.0 110.376 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -141.89 145.93 35.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.199 -0.938 . . . . 0.0 110.182 -179.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.92 -63.92 1.13 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.208 -0.933 . . . . 0.0 110.325 -179.964 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.97 40.93 1.67 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -129.45 127.79 41.61 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.159 -0.963 . . . . 0.0 110.157 179.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.9 147.69 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.133 -0.98 . . . . 0.0 110.227 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.9 m -135.67 143.05 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.153 -0.967 . . . . 0.0 110.244 179.936 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -117.59 116.38 26.97 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.164 -0.96 . . . . 0.0 110.266 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -132.12 118.6 19.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.187 -0.945 . . . . 0.0 110.23 179.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -119.72 117.42 28.2 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.208 -0.933 . . . . 0.0 110.214 -179.962 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 17.8 mt -125.67 138.18 53.89 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.28 -0.887 . . . . 0.0 110.17 -179.986 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.3 m -121.91 140.86 51.9 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.298 -0.876 . . . . 0.0 110.232 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.232 -179.997 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 mtp . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.7 80.83 1.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.192 -0.942 . . . . 0.0 110.292 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -134.79 49.66 2.21 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.132 -0.98 . . . . 0.0 110.294 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -142.42 117.09 9.78 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.182 -0.948 . . . . 0.0 110.22 179.796 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -117.51 146.84 43.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.138 -0.976 . . . . 0.0 110.329 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.449 ' CE2' ' CD ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -140.28 136.82 33.68 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.317 -0.864 . . . . 0.0 109.88 -179.882 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.1 m -151.74 160.85 43.44 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.198 -0.939 . . . . 0.0 110.056 178.942 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.415 ' CG2' ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -101.41 120.9 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.996 -1.065 . . . . 0.0 110.638 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -114.24 146.85 39.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.207 -0.933 . . . . 0.0 109.445 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.428 ' OH ' ' HB2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -100.22 147.16 26.03 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.854 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -83.99 128.18 34.37 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.008 179.987 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -151.77 38.02 0.59 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.176 -0.952 . . . . 0.0 110.77 179.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.58 50.82 0.18 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.183 -0.948 . . . . 0.0 110.887 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.41 -147.88 16.92 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -133.42 149.17 51.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.27 -1.136 . . . . 0.0 110.333 -179.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.4 132.09 45.6 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.206 -0.934 . . . . 0.0 110.678 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.73 121.9 28.17 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 179.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 34.8 t -62.78 137.54 58.29 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.324 -1.103 . . . . 0.0 110.298 -179.334 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -88.48 152.84 21.61 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 177.596 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.71 33.18 18.11 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.862 -1.149 . . . . 0.0 109.824 -178.413 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 150.78 0.35 Allowed 'General case' 0 N--CA 1.517 2.893 0 O-C-N 120.827 -1.17 . . . . 0.0 109.373 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -93.96 67.58 3.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.155 -0.965 . . . . 0.0 109.773 179.793 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -149.86 -176.27 5.36 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.256 -0.902 . . . . 0.0 110.403 -179.366 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -132.67 150.9 52.09 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.952 -1.092 . . . . 0.0 109.881 -179.236 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 13.4 mt -104.21 98.29 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.361 -0.837 . . . . 0.0 109.167 179.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 49.0 t -85.19 157.61 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 O-C-N 121.305 -0.872 . . . . 0.0 110.514 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -51.3 123.56 9.88 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.261 -0.899 . . . . 0.0 110.725 -179.605 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.19 -18.15 10.38 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 119.937 -1.125 . . . . 0.0 111.363 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 4.4 m -98.9 135.02 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 CA-C-N 119.584 1.692 . . . . 0.0 110.367 -179.51 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.42 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.4 p -79.55 131.65 36.08 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.934 179.851 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 4.4 ptt-85 -132.81 149.71 52.24 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.278 -0.889 . . . . 0.0 110.091 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.428 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 17.5 mt -106.25 130.8 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.151 -0.968 . . . . 0.0 109.841 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.46 138.43 14.25 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.406 -1.878 . . . . 0.0 108.406 179.225 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.449 ' CD ' ' CE2' ' A' ' 6' ' ' PHE . 9.0 ttpt -107.15 108.96 20.67 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.184 -1.186 . . . . 0.0 109.469 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 52.7 t -85.83 119.64 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.054 -1.029 . . . . 0.0 110.383 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 60.9 t -121.41 112.04 33.04 Favored Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.24 -0.912 . . . . 0.0 109.873 179.822 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.84 134.33 21.59 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 O-C-N 123.141 1.074 . . . . 0.0 110.544 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -103.54 160.81 24.96 Favored Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.19 140.08 30.37 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.392 1.207 . . . . 0.0 110.358 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 55.3 100.49 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.1 -1.0 . . . . 0.0 110.591 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 89.9 p -111.66 105.29 13.78 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.189 -0.944 . . . . 0.0 110.492 179.944 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -102.23 -54.78 2.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.239 -0.913 . . . . 0.0 109.832 179.467 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.43 -41.13 12.26 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.21 -0.931 . . . . 0.0 109.976 179.367 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -122.35 -111.51 2.11 Favored Glycine 0 N--CA 1.493 2.488 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.12 -65.18 0.48 Allowed Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.961 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -114.94 133.23 56.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -1.165 . . . . 0.0 109.922 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.6 mmt -117.3 144.41 44.9 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.182 -0.949 . . . . 0.0 110.523 -179.808 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -139.84 139.0 36.22 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.357 -0.839 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -111.04 130.91 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.192 -0.942 . . . . 0.0 109.6 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.424 ' CZ3' ' HA2' ' A' ' 33' ' ' GLY . 7.8 m95 -89.91 113.54 25.18 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.19 -0.944 . . . . 0.0 109.627 179.768 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.443 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -137.5 168.3 19.93 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.787 -1.165 . . . . 0.0 111.4 178.977 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -71.89 158.15 36.56 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.57 -0.706 . . . . 0.0 109.769 -179.151 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.449 ' CG2' ' CD1' ' A' ' 57' ' ' PHE . 51.1 mt -61.67 -44.58 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.264 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -31.4 65.57 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.253 -0.905 . . . . 0.0 110.552 179.461 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.4 m -70.76 -41.08 72.22 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.024 -1.048 . . . . 0.0 109.749 179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.9 tpt -76.31 -40.58 51.14 Favored 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.964 178.765 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CD1' ' CG2' ' A' ' 53' ' ' ILE . 7.5 m-85 -64.68 -33.27 75.56 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.543 178.507 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -58.15 -39.6 79.22 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.986 -1.071 . . . . 0.0 109.833 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.5 tttp -63.61 -40.08 95.99 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.585 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.95 -42.67 85.45 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.095 -1.003 . . . . 0.0 109.251 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.0 -35.46 73.28 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.234 -0.916 . . . . 0.0 109.327 178.501 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -105.78 31.53 4.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.18 169.23 9.01 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.902 -1.124 . . . . 0.0 110.013 179.958 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.48 155.7 17.69 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.176 -0.952 . . . . 0.0 110.241 -179.968 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -33.84 70.04 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.218 -0.926 . . . . 0.0 110.578 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.5 p -52.53 -35.17 52.8 Favored 'General case' 0 N--CA 1.514 2.738 0 O-C-N 120.878 -1.139 . . . . 0.0 110.781 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 29.7 p -114.49 107.65 15.81 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.053 -1.029 . . . . 0.0 110.385 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -121.23 144.91 48.35 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.202 -0.936 . . . . 0.0 110.011 179.742 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 150.1 43.93 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.183 -0.948 . . . . 0.0 110.803 -179.84 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.435 HD11 HG22 ' A' ' 70' ' ' ILE . 77.9 mt 52.87 99.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.187 -0.946 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.2 139.6 48.64 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 108.865 178.688 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 55.42 -163.74 0.14 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.948 -1.095 . . . . 0.0 109.712 -179.249 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.6 tt -106.49 -51.13 3.0 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.925 -1.109 . . . . 0.0 110.685 -179.845 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -80.73 77.43 7.58 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.097 -1.002 . . . . 0.0 110.167 -179.829 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -138.65 -58.61 0.62 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.131 -0.98 . . . . 0.0 110.499 179.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.416 ' N ' ' CD2' ' A' ' 76' ' ' LEU . 1.5 pt? -147.62 60.05 1.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.972 -1.08 . . . . 0.0 110.805 179.208 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.415 ' HB2' ' CG2' ' A' ' 8' ' ' VAL . 10.0 pt-20 -145.2 140.71 28.09 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.81 -1.181 . . . . 0.0 110.71 178.42 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.27 69.33 1.67 Allowed Glycine 0 N--CA 1.497 2.709 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 60.1 p-90 -91.47 -38.41 12.57 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.172 -1.193 . . . . 0.0 110.557 179.967 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -53.86 -28.3 35.21 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.08 -1.013 . . . . 0.0 111.261 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -91.19 -36.22 14.07 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.872 -1.143 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.5 mt -69.08 -173.93 0.56 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.989 -1.07 . . . . 0.0 109.848 -179.939 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.34 161.45 30.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.178 -0.952 . . . . 0.0 110.575 -179.562 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -77.6 -36.35 51.97 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.24 -0.912 . . . . 0.0 110.278 179.599 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -52.25 -37.53 55.55 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.989 -1.07 . . . . 0.0 110.126 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.428 ' HB2' ' OH ' ' A' ' 10' ' ' TYR . 0.7 OUTLIER -57.98 -40.57 80.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.205 -0.934 . . . . 0.0 109.311 178.812 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -37.53 64.9 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.325 -0.859 . . . . 0.0 109.984 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.402 ' O ' ' OG1' ' A' ' 91' ' ' THR . 3.0 tp10 -69.0 -41.42 77.84 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.257 -0.902 . . . . 0.0 109.27 179.139 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -64.95 -36.32 84.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.229 -0.919 . . . . 0.0 110.022 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.94 -41.1 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 67.8 p -60.15 -38.77 84.15 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.112 -0.992 . . . . 0.0 110.105 179.986 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -58.42 -38.51 77.57 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.214 -0.929 . . . . 0.0 110.061 179.694 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.414 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 8.0 m-70 -65.18 -53.52 43.54 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.552 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.77 -34.73 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.25 179.004 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.406 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -71.3 -39.38 71.49 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.148 -0.97 . . . . 0.0 109.55 179.111 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.54 -37.85 85.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 109.663 179.244 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.6 tp -78.85 -29.74 44.76 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.154 -0.966 . . . . 0.0 110.718 179.461 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -103.6 39.39 1.61 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.871 -1.143 . . . . 0.0 110.49 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.406 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 22.3 m -155.07 55.66 0.65 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.146 -0.971 . . . . 0.0 110.608 179.756 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -130.73 130.82 44.28 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.125 -0.985 . . . . 0.0 110.277 179.912 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -133.86 40.37 3.09 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.295 -0.878 . . . . 0.0 110.201 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.78 124.57 18.43 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.235 -0.915 . . . . 0.0 110.189 -179.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 99.88 -54.0 0.95 Allowed Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.7 m -123.04 93.4 48.32 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.189 -1.183 . . . . 0.0 110.122 -179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.92 143.42 36.64 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 O-C-N 123.431 1.227 . . . . 0.0 110.455 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -143.0 90.46 2.2 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.175 -0.953 . . . . 0.0 110.242 179.988 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.7 tptt -124.14 -61.29 1.37 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.156 -0.965 . . . . 0.0 110.186 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -149.8 101.13 3.03 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.13 -0.981 . . . . 0.0 110.57 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -134.35 154.17 51.49 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.188 -0.945 . . . . 0.0 110.091 179.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 7.9 p -130.17 145.73 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.136 -0.977 . . . . 0.0 110.394 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.6 t -140.61 144.12 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.094 -1.004 . . . . 0.0 110.042 -179.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -108.35 103.76 12.99 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.268 -0.895 . . . . 0.0 109.752 179.558 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -116.17 142.55 46.67 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.242 -0.911 . . . . 0.0 110.542 -179.529 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 24.3 mtpt -110.28 151.86 26.86 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.167 -0.958 . . . . 0.0 109.902 179.683 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.9 tp -105.37 110.15 22.39 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.24 -0.912 . . . . 0.0 110.323 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 6.9 t -140.87 150.68 43.54 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.238 -0.914 . . . . 0.0 110.15 179.897 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.0 p . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.227 -179.962 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.79 126.37 52.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.184 -0.948 . . . . 0.0 110.145 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.543 ' HB3' HD11 ' A' ' 76' ' ' LEU . 1.7 m-85 -120.77 142.8 49.22 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.27 -0.894 . . . . 0.0 110.186 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.455 ' O ' HG23 ' A' ' 32' ' ' ILE . 84.4 m -133.96 158.92 42.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.2 -0.937 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.73 ' CG2' HD23 ' A' ' 76' ' ' LEU . 58.4 t -116.81 125.76 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.149 -0.969 . . . . 0.0 110.05 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -142.61 158.46 43.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.147 -0.971 . . . . 0.0 110.668 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.446 ' OH ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -106.84 148.51 28.45 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.462 -0.774 . . . . 0.0 110.026 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.71 135.89 57.79 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.218 -0.927 . . . . 0.0 109.809 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -114.32 -56.44 2.39 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 110.291 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -153.36 130.97 11.48 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.181 -0.949 . . . . 0.0 110.655 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.85 158.19 23.43 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.893 HG22 HG22 ' A' ' 26' ' ' VAL . 77.0 p -118.14 136.98 53.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.208 -1.172 . . . . 0.0 110.063 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -129.07 132.17 47.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.126 -0.984 . . . . 0.0 110.483 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.01 111.27 3.96 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.9 t -65.15 157.76 27.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.26 -1.141 . . . . 0.0 109.182 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -87.63 155.54 19.9 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.584 -0.697 . . . . 0.0 110.197 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.54 28.26 4.64 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.266 -0.896 . . . . 0.0 111.914 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 p -172.1 163.82 6.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.787 -1.195 . . . . 0.0 111.295 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.74 53.64 0.86 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.232 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -136.03 -174.63 3.72 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.481 -0.762 . . . . 0.0 110.355 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.6 pttt -139.05 156.44 47.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.636 HG21 ' NH1' ' A' ' 31' ' ' ARG . 41.3 mt -95.52 105.32 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.368 -0.833 . . . . 0.0 109.564 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.893 HG22 HG22 ' A' ' 15' ' ' THR . 57.4 t -108.57 162.75 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.241 -0.912 . . . . 0.0 109.931 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -41.07 126.22 2.55 Favored 'General case' 0 N--CA 1.52 3.057 0 O-C-N 121.668 -0.645 . . . . 0.0 111.548 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 110.3 -3.84 29.78 Favored Glycine 0 N--CA 1.492 2.392 0 C-N-CA 120.111 -1.042 . . . . 0.0 111.125 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.1 t -110.48 134.12 53.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-N 119.564 1.682 . . . . 0.0 109.871 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.8 t -89.88 132.54 35.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.246 -0.909 . . . . 0.0 108.861 178.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.636 ' NH1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -130.86 151.99 50.68 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.145 -0.972 . . . . 0.0 111.308 -178.986 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 7' ' ' CYS . 38.5 mt -103.71 139.59 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.419 -0.801 . . . . 0.0 109.078 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.17 128.1 9.41 Favored Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 29.7 tttt -110.41 114.96 28.81 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.277 -1.131 . . . . 0.0 109.738 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.528 HG22 ' HB3' ' A' ' 48' ' ' LYS . 61.7 t -98.72 107.76 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.199 -0.938 . . . . 0.0 110.419 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.405 HG23 ' HD2' ' A' ' 37' ' ' PRO . 10.3 p -124.69 143.14 42.64 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.268 -0.895 . . . . 0.0 109.934 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.405 ' HD2' HG23 ' A' ' 36' ' ' VAL . 50.1 Cg_endo -76.11 127.56 10.02 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.261 1.137 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m120 . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 179.752 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.454 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -116.46 137.28 52.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.186 -1.185 . . . . 0.0 110.166 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.3 ttt -116.97 152.28 34.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.234 -0.917 . . . . 0.0 110.244 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HB3' HG22 ' A' ' 35' ' ' VAL . 13.2 pttt -125.03 145.16 50.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.266 -0.896 . . . . 0.0 110.617 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.28 156.62 43.7 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.0 109.652 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -101.55 142.3 33.13 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.15 -0.968 . . . . 0.0 110.127 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -121.3 174.14 6.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.314 -0.866 . . . . 0.0 110.718 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 2.8 m80 -93.65 -173.82 3.29 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.981 HG22 ' CE1' ' A' ' 93' ' ' HIS . 45.5 mm -83.27 -33.73 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.32 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -90.57 -33.89 15.71 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.771 -1.206 . . . . 0.0 110.686 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 73.2 m -63.24 -52.31 62.67 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.927 -1.108 . . . . 0.0 110.307 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.1 88.96 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.275 -0.891 . . . . 0.0 110.375 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.444 ' CE1' HG13 ' A' ' 94' ' ' ILE . 10.4 m-85 -75.17 -30.35 60.7 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.02 -1.072 . . . . 0.0 109.751 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -68.23 -36.18 79.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.981 -1.074 . . . . 0.0 109.564 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 41.2 tttm -59.97 -40.05 87.74 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.996 . . . . 0.0 109.761 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -59.89 -44.91 93.97 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.738 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -58.56 -35.1 71.84 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.212 -0.93 . . . . 0.0 110.436 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 ttt-85 -89.71 -29.2 18.91 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.18 -0.95 . . . . 0.0 111.01 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.509 2.512 0 O-C-N 120.826 -1.171 . . . . 0.0 110.186 -179.807 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.9 mtpt . . . . . 0 N--CA 1.493 1.72 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.4 mt 54.36 98.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.116 -0.99 . . . . 0.0 110.562 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -110.29 141.77 42.84 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.139 -0.976 . . . . 0.0 110.02 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -165.56 0.08 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.056 -1.027 . . . . 0.0 110.516 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.559 HD21 ' HG3' ' A' ' 87' ' ' LYS . 15.9 tp -114.72 37.64 3.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.139 -0.975 . . . . 0.0 110.508 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -152.96 36.74 0.49 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.067 -1.021 . . . . 0.0 110.8 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.653 ' O ' HD12 ' A' ' 76' ' ' LEU . 48.1 mm-40 -125.35 38.81 4.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.119 -0.988 . . . . 0.0 109.776 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.73 HD23 ' CG2' ' A' ' 8' ' ' VAL . 1.0 OUTLIER -147.82 153.67 39.48 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.213 -0.93 . . . . 0.0 110.109 -179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -89.95 97.67 11.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.116 -0.99 . . . . 0.0 110.065 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.19 -35.25 0.84 Allowed Glycine 0 N--CA 1.495 2.63 0 C-N-CA 119.724 -1.227 . . . . 0.0 110.963 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.448 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 27.2 p-90 -52.09 -30.66 27.07 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.006 1.403 . . . . 0.0 111.062 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.448 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.6 tm-20 -60.0 -42.98 95.46 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 120.907 -1.121 . . . . 0.0 109.684 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.31 -39.46 90.58 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.172 -0.955 . . . . 0.0 109.816 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.6 mp -49.93 173.72 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.855 0 O-C-N 121.17 -0.956 . . . . 0.0 110.759 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -107.13 161.85 14.39 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.178 -0.951 . . . . 0.0 110.388 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.19 -43.9 74.82 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.132 -0.98 . . . . 0.0 110.481 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -62.43 -51.15 68.67 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.262 -0.899 . . . . 0.0 109.43 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.446 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 0.6 OUTLIER -62.19 -38.88 90.8 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.297 -0.877 . . . . 0.0 109.331 179.031 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.559 ' HG3' HD21 ' A' ' 73' ' ' LEU . 24.3 tttt -59.43 -39.19 82.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.233 -0.917 . . . . 0.0 109.775 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -59.99 -40.0 87.64 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.715 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.12 -38.94 92.86 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.219 -0.926 . . . . 0.0 110.019 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.49 ' CD1' HD12 ' A' ' 53' ' ' ILE . 45.9 mm -68.45 -41.51 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.152 -0.967 . . . . 0.0 109.026 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.543 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -60.55 -38.17 83.62 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.23 -0.919 . . . . 0.0 109.935 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -58.93 -40.23 83.97 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.149 -0.97 . . . . 0.0 109.991 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.981 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.3 m-70 -59.93 -47.61 85.08 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.206 -0.934 . . . . 0.0 109.933 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' CE1' ' A' ' 57' ' ' PHE . 19.4 mt -63.67 -39.25 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.202 -0.936 . . . . 0.0 109.61 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.03 95.83 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.216 -0.927 . . . . 0.0 109.438 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.24 -40.44 67.71 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.229 -0.919 . . . . 0.0 109.088 178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.425 HD22 ' HD1' ' A' ' 57' ' ' PHE . 50.1 tp -68.45 -33.12 73.62 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.196 -0.94 . . . . 0.0 110.228 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.7 t -93.96 -58.81 2.13 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.945 -1.097 . . . . 0.0 110.007 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.501 2.115 0 O-C-N 121.04 -1.037 . . . . 0.0 110.89 179.804 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -119.82 138.44 53.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.264 -0.898 . . . . 0.0 110.205 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.642 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.9 m-85 -118.21 150.06 40.04 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.219 -0.925 . . . . 0.0 110.284 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.9 m -134.15 156.39 48.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.262 -0.899 . . . . 0.0 110.032 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 52.6 t -109.82 135.54 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.118 -0.989 . . . . 0.0 110.028 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -148.35 153.58 38.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.185 -0.947 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -110.87 148.44 32.42 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.41 -0.807 . . . . 0.0 109.549 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.29 130.92 41.91 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.514 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -138.05 -65.68 0.51 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.171 -0.956 . . . . 0.0 110.432 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -116.98 110.87 18.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.214 -0.929 . . . . 0.0 110.318 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.18 142.34 10.49 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 25' ' ' ILE . 5.4 m -116.26 135.88 53.5 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.205 -1.174 . . . . 0.0 110.048 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.28 144.51 31.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.182 -0.949 . . . . 0.0 110.51 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -68.7 156.34 53.35 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -91.83 143.86 26.08 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.211 -1.17 . . . . 0.0 108.726 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CB ' ' CE2' ' A' ' 51' ' ' TYR . 4.3 mmtt -52.91 147.32 9.32 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 120.86 -1.15 . . . . 0.0 110.311 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt 53.28 62.01 2.87 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.137 -0.977 . . . . 0.0 110.242 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.3 t -172.49 148.7 2.04 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.917 -1.114 . . . . 0.0 111.913 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -107.45 45.99 0.97 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -132.51 -171.84 2.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.591 -0.693 . . . . 0.0 109.956 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -135.3 153.09 51.99 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.026 -1.047 . . . . 0.0 110.535 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.721 HG23 ' CG2' ' A' ' 29' ' ' VAL . 72.0 mt -107.01 112.88 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.371 -0.83 . . . . 0.0 109.6 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.493 HG22 ' HG2' ' A' ' 27' ' ' LYS . 13.4 p -111.11 161.19 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.195 -0.941 . . . . 0.0 110.609 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.493 ' HG2' HG22 ' A' ' 26' ' ' VAL . 1.6 ptpp? -46.22 120.24 2.7 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 121.437 -0.79 . . . . 0.0 111.282 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 125.22 -22.0 6.37 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.999 -1.096 . . . . 0.0 111.004 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.721 ' CG2' HG23 ' A' ' 25' ' ' ILE . 8.9 m -100.69 138.21 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 CA-C-N 119.342 1.571 . . . . 0.0 110.52 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 42.4 t -82.66 141.96 32.08 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.233 -0.917 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.45 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 3.5 ptt85 -138.19 150.41 46.73 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.325 -0.859 . . . . 0.0 110.174 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.1 mt -105.62 144.25 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.293 -0.879 . . . . 0.0 109.98 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.89 132.13 10.99 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.424 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 27.5 ttpt -116.36 115.33 25.69 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.095 -1.238 . . . . 0.0 110.066 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.446 HG22 ' HG3' ' A' ' 48' ' ' LYS . 59.0 t -102.12 111.13 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.158 -0.964 . . . . 0.0 110.436 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.8 p -122.51 143.4 39.63 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.195 -0.94 . . . . 0.0 110.257 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -78.38 150.03 24.99 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 O-C-N 123.123 1.065 . . . . 0.0 110.634 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 N--CA 1.5 2.044 0 O-C-N 121.306 -0.872 . . . . 0.0 110.108 179.652 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.734 0 N-CA-C 109.824 -1.311 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -114.57 152.71 31.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.192 -1.181 . . . . 0.0 110.037 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.0 mmt -112.56 124.97 53.73 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.276 -0.89 . . . . 0.0 110.35 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.446 ' HG3' HG22 ' A' ' 35' ' ' VAL . 21.0 ttmt -117.7 122.27 43.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.213 -0.929 . . . . 0.0 110.147 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -127.44 152.21 47.83 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.194 -0.942 . . . . 0.0 109.85 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 72.1 m95 -98.83 141.93 30.99 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.234 -0.916 . . . . 0.0 110.081 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CE2' ' CB ' ' A' ' 19' ' ' LYS . 96.0 m-85 -120.73 174.25 6.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.304 -0.873 . . . . 0.0 110.465 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -95.24 -173.12 2.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.949 HG22 ' CE1' ' A' ' 93' ' ' HIS . 40.9 mm -87.16 -37.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.051 -1.031 . . . . 0.0 109.263 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -88.99 -27.95 20.54 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.887 -1.133 . . . . 0.0 110.821 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 65.7 m -71.58 -49.15 43.14 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.966 -1.084 . . . . 0.0 109.911 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.35 -37.34 83.09 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.36 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.448 ' CE1' HG13 ' A' ' 94' ' ' ILE . 5.9 m-85 -74.33 -32.8 62.96 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 118.952 -1.099 . . . . 0.0 109.588 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -63.37 -36.74 84.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.49 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 24.9 mtpp -59.9 -40.02 87.35 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.135 -0.978 . . . . 0.0 109.779 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -58.11 -45.28 87.52 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.179 -0.95 . . . . 0.0 109.262 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -59.56 -36.07 75.47 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 119.574 -0.851 . . . . 0.0 109.407 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -108.61 32.3 4.96 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.311 -0.868 . . . . 0.0 110.368 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.604 ' HB2' ' O ' ' A' ' 59' ' ' LYS . . . . . . . . 0 N--CA 1.497 1.884 0 O-C-N 120.909 -1.119 . . . . 0.0 110.22 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.1 mttt . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.568 HG23 HD11 ' A' ' 76' ' ' LEU . 77.2 mt 55.18 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.202 -0.936 . . . . 0.0 110.791 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -108.91 141.45 40.96 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.197 -0.94 . . . . 0.0 109.961 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 53.17 -173.06 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.987 -1.071 . . . . 0.0 110.677 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.677 HD22 ' OG1' ' A' ' 91' ' ' THR . 14.1 tp -98.39 -35.53 10.26 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.178 -0.951 . . . . 0.0 111.102 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -102.8 50.23 0.82 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.918 -1.114 . . . . 0.0 110.446 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -125.5 38.17 4.22 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.196 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 6' ' ' PHE . 48.4 mt -145.48 155.2 42.96 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.216 -0.927 . . . . 0.0 110.135 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -84.46 97.69 9.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.055 -1.028 . . . . 0.0 110.277 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.72 -37.32 0.62 Allowed Glycine 0 N--CA 1.497 2.736 0 C-N-CA 119.689 -1.243 . . . . 0.0 111.036 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.451 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 34.8 p-90 -55.22 -33.3 62.96 Favored 'General case' 0 N--CA 1.513 2.717 0 O-C-N 120.872 -1.369 . . . . 0.0 110.728 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.451 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.2 tt0 -54.18 -39.48 66.65 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.91 -1.119 . . . . 0.0 110.243 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -72.25 -36.43 69.07 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.212 -0.93 . . . . 0.0 110.02 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.43 HD23 ' CB ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -53.25 -179.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.793 0 O-C-N 121.104 -0.998 . . . . 0.0 110.343 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -106.76 161.07 14.99 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.12 -0.987 . . . . 0.0 110.33 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.41 -39.94 81.12 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.391 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -66.23 -42.3 88.83 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.585 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.43 ' CB ' HD23 ' A' ' 82' ' ' LEU . 75.8 mt-10 -66.73 -39.89 88.16 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.539 -0.864 . . . . 0.0 109.359 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.691 ' HA ' HD12 ' A' ' 90' ' ' ILE . 35.8 mtpt -60.54 -38.38 84.29 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.265 -0.897 . . . . 0.0 109.9 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.02 -40.36 84.74 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.879 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.44 -40.19 96.49 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 87' ' ' LYS . 12.0 mt -65.38 -40.79 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.235 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.677 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.9 OUTLIER -59.22 -38.76 80.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.177 -0.952 . . . . 0.0 109.958 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -39.94 80.52 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.283 -0.886 . . . . 0.0 109.897 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.949 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.5 m-70 -58.35 -47.39 83.93 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.135 -0.978 . . . . 0.0 109.846 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.448 HG13 ' CE1' ' A' ' 57' ' ' PHE . 26.0 mt -66.12 -38.23 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.241 -0.912 . . . . 0.0 109.511 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.43 81.1 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.127 -0.983 . . . . 0.0 109.386 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.46 -41.89 68.84 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.217 -0.927 . . . . 0.0 108.836 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.425 HD22 ' HD1' ' A' ' 57' ' ' PHE . 28.5 tp -71.0 -33.64 70.6 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.345 -0.847 . . . . 0.0 109.815 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 41.3 m -100.67 46.73 0.94 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.968 -1.082 . . . . 0.0 110.075 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.174 -0.954 . . . . 0.0 110.368 179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 . . . . . 0 N--CA 1.495 1.782 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.06 121.65 32.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.197 -0.939 . . . . 0.0 110.308 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.595 ' HD1' HG22 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -112.5 144.49 41.87 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.171 -0.955 . . . . 0.0 109.722 179.687 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.7 p -135.65 164.62 27.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.899 . . . . 0.0 110.177 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.708 HG13 HD12 ' A' ' 76' ' ' LEU . 34.1 m -125.26 140.77 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.173 -0.955 . . . . 0.0 110.955 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -146.78 97.4 2.9 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.146 -0.971 . . . . 0.0 110.163 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.62 ' CD2' HD13 ' A' ' 82' ' ' LEU . 7.3 m-85 -54.06 154.61 4.09 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.188 -0.945 . . . . 0.0 110.456 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.524 ' HB2' ' HE ' ' A' ' 31' ' ' ARG . . . -108.32 131.21 54.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.279 -0.888 . . . . 0.0 110.696 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -117.09 -57.81 2.12 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.242 -0.911 . . . . 0.0 109.912 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.7 mtm-85 -119.12 159.43 23.97 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.242 -0.912 . . . . 0.0 110.02 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.758 ' O ' HG23 ' A' ' 26' ' ' VAL . . . 81.64 162.42 29.59 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.53 HG23 ' HB ' ' A' ' 26' ' ' VAL . 17.5 m -133.86 144.21 48.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.144 -1.21 . . . . 0.0 110.322 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -135.77 143.42 45.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.737 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -74.37 123.51 7.78 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 11.0 t -62.35 130.61 46.05 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.272 -1.134 . . . . 0.0 109.412 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -61.89 147.8 45.54 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.173 -0.954 . . . . 0.0 109.209 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? 52.87 46.88 25.87 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.994 -1.066 . . . . 0.0 109.567 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.2 t -165.59 153.93 11.36 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.343 -0.848 . . . . 0.0 110.944 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -105.38 44.66 1.02 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -138.7 -175.03 4.0 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.464 -0.772 . . . . 0.0 109.978 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB3' HG22 ' A' ' 15' ' ' THR . 0.0 OUTLIER -133.56 157.24 46.18 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.203 -0.935 . . . . 0.0 110.06 -179.382 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.923 HG23 ' CG1' ' A' ' 29' ' ' VAL . 59.7 mt -112.61 123.28 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.395 -0.816 . . . . 0.0 109.956 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 14' ' ' GLY . 8.9 p -165.45 112.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.112 -0.992 . . . . 0.0 111.364 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.47 126.76 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.198 -0.939 . . . . 0.0 111.632 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.48 9.34 81.77 Favored Glycine 0 N--CA 1.496 2.652 0 O-C-N 121.077 -1.014 . . . . 0.0 111.808 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.923 ' CG1' HG23 ' A' ' 25' ' ' ILE . 95.1 t -126.66 135.59 63.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.708 1.754 . . . . 0.0 110.085 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.882 ' HB3' HD11 ' A' ' 53' ' ' ILE . 5.4 t -95.78 134.91 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.179 -0.95 . . . . 0.0 109.24 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.844 ' CG ' HG21 ' A' ' 25' ' ' ILE . 25.3 mtm180 -113.6 129.3 56.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.127 -0.983 . . . . 0.0 110.771 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.595 HG22 ' HD1' ' A' ' 6' ' ' PHE . 12.2 mt -103.81 128.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.215 -0.928 . . . . 0.0 108.515 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.9 130.52 10.27 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 21.0 tttm -107.03 113.53 27.06 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.334 -1.098 . . . . 0.0 109.393 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.491 HG22 ' HB3' ' A' ' 48' ' ' LYS . 48.7 t -96.72 112.76 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.142 -0.973 . . . . 0.0 110.538 -179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.1 t -120.77 111.03 34.69 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -73.39 127.35 11.77 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.205 1.108 . . . . 0.0 110.427 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 m120 . . . . . 0 N--CA 1.499 1.99 0 O-C-N 121.179 -0.95 . . . . 0.0 110.084 179.78 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.54 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -134.58 138.87 44.94 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.235 -1.156 . . . . 0.0 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.2 mtp -117.02 149.58 40.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.173 -0.954 . . . . 0.0 110.233 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HB3' HG22 ' A' ' 35' ' ' VAL . 24.0 pttt -129.46 144.91 51.45 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.32 -0.862 . . . . 0.0 110.534 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -122.76 148.06 45.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.147 -0.971 . . . . 0.0 109.581 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -93.99 151.07 19.8 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.104 -0.997 . . . . 0.0 110.133 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -135.03 173.22 11.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.279 -0.888 . . . . 0.0 110.414 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.436 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -96.03 -172.34 2.54 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.876 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.928 HG22 ' CE1' ' A' ' 93' ' ' HIS . 43.6 mm -84.38 -39.85 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 121.09 -1.006 . . . . 0.0 108.777 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -89.02 -25.68 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.922 -1.111 . . . . 0.0 111.081 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.7 m -75.95 -42.2 49.31 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.78 -1.2 . . . . 0.0 109.987 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -38.18 66.62 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.86 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.456 ' CE1' HG13 ' A' ' 94' ' ' ILE . 6.9 m-85 -73.6 -31.82 63.78 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 119.029 -1.068 . . . . 0.0 109.553 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -63.91 -38.24 90.37 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.052 -1.03 . . . . 0.0 109.337 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -41.17 97.7 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.515 179.379 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.99 -46.02 90.84 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.287 -0.883 . . . . 0.0 109.302 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -56.35 -33.73 65.95 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.765 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 24.7 mtp-105 -105.85 30.24 5.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.174 -0.953 . . . . 0.0 110.627 179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.948 0 O-C-N 120.906 -1.121 . . . . 0.0 109.97 179.687 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 120.706 0.289 . . . . 0.0 110.256 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.3 mt 54.41 98.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.126 -0.984 . . . . 0.0 110.661 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -114.2 138.06 50.96 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.183 -0.948 . . . . 0.0 110.069 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.33 -166.01 0.07 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.061 -1.024 . . . . 0.0 110.596 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.749 HD22 ' OG1' ' A' ' 91' ' ' THR . 4.5 tp -115.63 39.54 2.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.176 -0.953 . . . . 0.0 110.374 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.599 HG22 ' CZ2' ' A' ' 79' ' ' TRP . 2.9 p -149.28 38.04 0.78 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.577 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.679 ' C ' HD22 ' A' ' 76' ' ' LEU . 3.2 mp0 -137.02 37.08 2.57 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.23 -0.919 . . . . 0.0 110.247 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.708 HD12 HG13 ' A' ' 8' ' ' VAL . 4.2 mm? -122.09 152.25 40.04 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.113 -0.992 . . . . 0.0 109.906 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.35 106.76 0.8 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.312 -0.868 . . . . 0.0 111.359 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 65.81 59.31 7.73 Favored Glycine 0 N--CA 1.492 2.423 0 O-C-N 121.247 -0.908 . . . . 0.0 111.161 178.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.599 ' CZ2' HG22 ' A' ' 74' ' ' THR . 34.9 p-90 -88.94 -38.19 14.67 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.967 -1.314 . . . . 0.0 109.952 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.474 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 8.5 tm-20 -69.2 -40.74 77.87 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.164 -0.96 . . . . 0.0 109.082 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.24 -28.02 50.36 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.199 -0.938 . . . . 0.0 111.144 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.62 HD13 ' CD2' ' A' ' 10' ' ' TYR . 95.6 mt -69.81 -175.06 0.83 Allowed 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.624 -1.297 . . . . 0.0 109.762 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -62.76 155.25 27.18 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.168 -0.957 . . . . 0.0 110.06 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -87.88 -41.07 13.46 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.241 -0.912 . . . . 0.0 110.192 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -65.66 -43.99 87.7 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.28 -0.887 . . . . 0.0 109.56 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 47.8 mt-10 -64.63 -39.47 93.76 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.332 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.49 ' HG3' HD21 ' A' ' 73' ' ' LEU . 12.7 tptt -58.52 -39.16 79.34 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.257 -0.902 . . . . 0.0 109.76 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.7 -37.93 74.33 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.242 -0.911 . . . . 0.0 109.969 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -59.24 -39.22 82.08 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.232 -0.917 . . . . 0.0 110.062 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 70.2 mt -64.53 -41.05 91.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 O-C-N 121.169 -0.957 . . . . 0.0 109.058 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.749 ' OG1' HD22 ' A' ' 73' ' ' LEU . 2.0 m -57.08 -38.45 73.34 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.179 -0.95 . . . . 0.0 109.966 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.11 -40.35 80.99 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.223 -0.923 . . . . 0.0 109.8 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.928 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.1 m-70 -60.39 -50.59 72.98 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.163 -0.961 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.456 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.0 mt -62.5 -39.44 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 109.471 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.67 -41.31 96.18 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.218 -0.926 . . . . 0.0 109.272 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.53 -40.99 69.71 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.028 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.9 tp -69.64 -33.85 73.2 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.282 -0.886 . . . . 0.0 110.073 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 18.2 t -96.44 -65.5 0.96 Allowed 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.1 t . . . . . 0 N--CA 1.501 2.081 0 O-C-N 121.079 -1.013 . . . . 0.0 110.792 -179.971 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.634 ' HA ' HG12 ' A' ' 36' ' ' VAL . 2.7 tt0 . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 120.898 0.38 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -128.13 137.48 52.13 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.134 -0.978 . . . . 0.0 110.271 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.697 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.5 m-85 -115.98 137.65 51.92 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.136 -0.978 . . . . 0.0 110.162 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -122.25 164.93 17.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.25 -0.906 . . . . 0.0 109.308 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.544 HG12 HG23 ' A' ' 32' ' ' ILE . 32.7 m -134.97 134.3 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.926 -1.109 . . . . 0.0 110.815 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -139.93 147.63 40.81 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.211 -0.93 . . . . 0.0 109.876 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.569 ' HD2' HD22 ' A' ' 82' ' ' LEU . 1.7 m-85 -101.44 148.03 25.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.239 -0.913 . . . . 0.0 109.985 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.642 ' HB2' ' HD2' ' A' ' 31' ' ' ARG . . . -108.09 144.87 34.87 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.289 -0.882 . . . . 0.0 110.557 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -115.17 -56.4 2.37 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.224 -0.923 . . . . 0.0 110.122 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 mtt85 -141.39 72.95 1.4 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.565 ' O ' HG22 ' A' ' 26' ' ' VAL . . . -141.48 -176.2 15.61 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.459 ' HA ' HG22 ' A' ' 26' ' ' VAL . 34.9 m -140.22 116.16 10.35 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.154 -1.204 . . . . 0.0 110.235 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.19 133.3 24.36 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.163 -0.96 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -76.62 123.33 6.66 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.2 t -61.4 127.78 33.14 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.266 -1.138 . . . . 0.0 109.483 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -61.51 147.94 43.69 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.188 -0.945 . . . . 0.0 109.201 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 54.21 44.24 29.4 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.872 -1.142 . . . . 0.0 109.468 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.4 t -165.87 149.65 7.92 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.374 -0.829 . . . . 0.0 110.692 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 tttt -101.09 51.27 0.85 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 0.0 108.678 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.16 -174.99 4.44 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.453 -0.78 . . . . 0.0 110.339 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -133.67 161.05 35.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.184 -0.947 . . . . 0.0 109.759 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.822 HG23 ' CG1' ' A' ' 29' ' ' VAL . 51.7 mt -111.28 110.86 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.408 -0.808 . . . . 0.0 109.775 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 14' ' ' GLY . 57.5 t -141.04 103.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.134 -0.978 . . . . 0.0 111.455 -179.187 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.8 tttp 59.91 142.4 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.204 -0.935 . . . . 0.0 112.171 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.94 12.64 65.31 Favored Glycine 0 N--CA 1.497 2.754 0 O-C-N 121.088 -1.008 . . . . 0.0 111.841 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.822 ' CG1' HG23 ' A' ' 25' ' ' ILE . 84.0 t -128.77 136.65 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 CA-C-N 119.786 1.793 . . . . 0.0 110.486 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.886 ' HB3' HD11 ' A' ' 53' ' ' ILE . 3.0 t -94.57 131.55 40.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.284 -0.885 . . . . 0.0 108.788 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 11' ' ' ALA . 8.7 mtp180 -106.52 129.31 54.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.149 -0.969 . . . . 0.0 110.719 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.544 HG23 HG12 ' A' ' 8' ' ' VAL . 12.2 mt -104.31 127.11 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.91 126.97 9.07 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.422 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.7 ttpm? -103.44 107.83 18.83 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.365 -1.079 . . . . 0.0 109.331 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -102.03 107.86 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.161 -0.962 . . . . 0.0 110.605 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.634 HG12 ' HA ' ' A' ' 4' ' ' GLN . 34.4 m -123.57 146.22 49.4 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.282 -0.886 . . . . 0.0 109.778 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -76.04 135.62 17.42 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.224 1.118 . . . . 0.0 110.353 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 . . . . . 0 N--CA 1.5 2.036 0 O-C-N 121.182 -0.949 . . . . 0.0 109.886 179.7 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.473 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -134.32 142.21 47.18 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.239 -1.153 . . . . 0.0 110.039 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 34.8 mtp -117.71 137.09 52.92 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.117 -0.989 . . . . 0.0 110.618 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -131.56 129.11 40.56 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.218 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -132.84 155.01 49.76 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.206 -0.934 . . . . 0.0 109.888 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -98.49 163.37 12.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.115 -0.99 . . . . 0.0 110.006 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -145.71 172.37 13.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.227 -0.92 . . . . 0.0 110.596 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 -172.27 2.68 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.941 HG22 ' CE1' ' A' ' 93' ' ' HIS . 45.2 mm -86.72 -40.07 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.088 0 O-C-N 121.021 -1.049 . . . . 0.0 108.999 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -89.32 -24.47 22.0 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 120.864 -1.148 . . . . 0.0 111.012 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.4 m -75.17 -44.87 44.3 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.734 -1.229 . . . . 0.0 110.01 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -37.66 69.3 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.919 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.451 ' CE1' HG13 ' A' ' 94' ' ' ILE . 8.0 m-85 -74.08 -31.8 62.98 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.417 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.08 -37.75 88.44 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.002 -1.061 . . . . 0.0 109.531 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 7.0 tttp -58.71 -39.56 81.14 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.117 -0.989 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.3 mp -59.35 -43.33 92.81 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.264 -0.898 . . . . 0.0 109.299 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -36.16 74.95 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.282 -0.886 . . . . 0.0 109.513 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.3 mmt-85 -105.86 31.28 5.15 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.241 -0.912 . . . . 0.0 110.561 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 59' ' ' LYS . . . . . . . . 0 N--CA 1.496 1.854 0 O-C-N 120.907 -1.121 . . . . 0.0 110.109 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 22.9 mtmm . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 120.775 0.321 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.691 HG23 HD11 ' A' ' 76' ' ' LEU . 76.4 mt 53.78 97.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.091 -1.006 . . . . 0.0 110.809 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -113.32 133.76 54.96 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.197 -0.939 . . . . 0.0 109.692 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 53.08 -170.54 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.958 -1.089 . . . . 0.0 110.333 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.492 HD21 ' HG2' ' A' ' 87' ' ' LYS . 27.5 tp -108.39 -58.58 1.98 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.081 -1.012 . . . . 0.0 110.051 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -33.74 70.16 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.166 -0.959 . . . . 0.0 110.544 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -49.07 -33.78 12.26 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 120.989 -1.07 . . . . 0.0 111.462 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 6' ' ' PHE . 54.7 mt -82.65 152.38 25.88 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.008 -1.058 . . . . 0.0 109.994 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -92.75 136.58 33.11 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.266 -0.896 . . . . 0.0 110.572 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 136.75 -47.49 0.96 Allowed Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.512 ' HA ' HD12 ' A' ' 82' ' ' LEU . 54.7 p-90 -50.48 -30.24 12.3 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.15 -1.206 . . . . 0.0 111.449 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.444 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 6.4 tm-20 -52.52 -28.85 22.29 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.883 -1.136 . . . . 0.0 111.28 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -113.06 29.31 8.08 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.95 -1.094 . . . . 0.0 111.788 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.569 HD22 ' HD2' ' A' ' 10' ' ' TYR . 33.3 mt -113.28 -165.85 1.03 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.854 -1.154 . . . . 0.0 109.799 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -100.78 162.21 13.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.049 -1.032 . . . . 0.0 110.068 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -79.12 -39.77 32.77 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.202 -0.936 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -69.19 -41.42 77.16 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.159 -0.963 . . . . 0.0 109.501 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -39.15 73.05 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.918 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.579 ' HA ' HD12 ' A' ' 90' ' ' ILE . 7.1 ttpt -61.11 -39.23 89.2 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.171 -0.955 . . . . 0.0 109.531 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -56.93 -34.9 68.43 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.141 -0.974 . . . . 0.0 110.212 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -58.12 -39.41 78.63 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.16 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 87' ' ' LYS . 10.9 mt -66.29 -40.88 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.401 0 O-C-N 121.176 -0.953 . . . . 0.0 109.219 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.1 m -58.9 -37.89 77.65 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.256 -0.903 . . . . 0.0 110.0 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -58.9 -40.47 84.58 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.154 -0.966 . . . . 0.0 109.822 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.941 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.7 m-70 -60.38 -49.66 76.7 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.155 -0.966 . . . . 0.0 109.75 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.451 HG13 ' CE1' ' A' ' 57' ' ' PHE . 13.9 mt -63.79 -39.4 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.215 -0.928 . . . . 0.0 109.565 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.18 -40.7 98.27 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.142 -0.974 . . . . 0.0 109.341 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -71.86 -38.3 70.08 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.261 -0.9 . . . . 0.0 109.226 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.0 tp -72.95 -37.34 67.16 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.271 -0.893 . . . . 0.0 109.951 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 m -65.28 -51.47 60.57 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.098 -1.001 . . . . 0.0 109.991 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.74 0 O-C-N 121.173 -0.955 . . . . 0.0 110.305 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 . . . . . 0 N--CA 1.495 1.792 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -124.51 131.61 53.49 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.266 -0.896 . . . . 0.0 110.185 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.718 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.5 m-85 -125.15 136.76 53.93 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.153 -0.967 . . . . 0.0 110.275 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.412 ' O ' HG23 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -121.89 164.12 18.09 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.243 -0.91 . . . . 0.0 109.062 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.479 HG13 ' HB3' ' A' ' 76' ' ' LEU . 25.4 m -130.95 134.98 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.945 -1.097 . . . . 0.0 110.465 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -139.67 156.69 46.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.151 -0.968 . . . . 0.0 110.2 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.622 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.5 OUTLIER -105.97 156.15 18.66 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.366 -0.834 . . . . 0.0 110.069 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.725 ' HB1' ' HA ' ' A' ' 26' ' ' VAL . . . -103.05 102.67 12.71 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.261 -0.899 . . . . 0.0 110.503 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -115.13 -56.21 2.39 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.303 -0.873 . . . . 0.0 109.94 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -114.91 83.19 1.86 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.202 -0.936 . . . . 0.0 110.029 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.675 ' O ' HG23 ' A' ' 26' ' ' VAL . . . 142.08 170.47 12.57 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -143.91 140.84 29.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.175 -1.191 . . . . 0.0 110.531 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.03 147.38 51.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.249 -0.907 . . . . 0.0 110.471 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.43 122.05 5.83 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.499 ' CA ' HD11 ' A' ' 25' ' ' ILE . 7.1 t -64.49 124.54 22.1 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.177 -1.19 . . . . 0.0 109.447 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 148.54 40.32 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.999 -1.063 . . . . 0.0 108.939 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 mttm 52.85 64.1 1.99 Allowed 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.982 -1.074 . . . . 0.0 108.984 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.5 t -172.98 -44.45 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.264 -0.897 . . . . 0.0 112.54 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt 70.08 44.15 0.81 Allowed 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.935 -1.103 . . . . 0.0 108.341 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -141.05 -170.05 2.96 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.539 -0.726 . . . . 0.0 109.364 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -127.6 156.02 42.93 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.883 -1.135 . . . . 0.0 110.92 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.905 HG23 ' CG1' ' A' ' 29' ' ' VAL . 15.8 mt -120.09 104.2 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -0.757 . . . . 0.0 109.615 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.725 ' HA ' ' HB1' ' A' ' 11' ' ' ALA . 10.1 p -163.84 147.59 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.084 -1.01 . . . . 0.0 111.578 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt 53.94 102.82 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.381 -0.824 . . . . 0.0 111.664 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.22 11.28 85.05 Favored Glycine 0 N--CA 1.494 2.549 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.012 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.905 ' CG1' HG23 ' A' ' 25' ' ' ILE . 93.1 t -121.78 135.2 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 CA-C-N 119.87 1.835 . . . . 0.0 110.634 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.889 ' HB3' HD11 ' A' ' 53' ' ' ILE . 1.7 t -105.75 141.19 37.61 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.26 -0.9 . . . . 0.0 108.829 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.631 ' HB3' HG21 ' A' ' 25' ' ' ILE . 3.2 ptp180 -122.21 144.66 48.83 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.154 -0.966 . . . . 0.0 111.408 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 7' ' ' CYS . 17.6 mt -107.16 137.51 37.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.339 -0.851 . . . . 0.0 109.412 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.446 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.32 128.2 9.39 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.164 -1.575 . . . . 0.0 109.164 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 30.0 tttt -112.23 117.53 32.79 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.192 -1.181 . . . . 0.0 109.973 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.8 t -100.55 109.04 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.072 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.3 t -120.79 124.38 27.54 Favored Pre-proline 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 109.773 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.85 142.58 35.47 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 O-C-N 123.146 1.077 . . . . 0.0 110.452 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 N--CA 1.499 2.003 0 O-C-N 121.16 -0.963 . . . . 0.0 110.216 179.777 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.609 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -146.09 135.11 22.63 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.16 -1.2 . . . . 0.0 110.351 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.5 mtp -117.62 141.52 48.28 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.194 -0.941 . . . . 0.0 110.366 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -130.42 127.71 39.86 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.132 -0.98 . . . . 0.0 110.25 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.92 153.57 42.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.122 -0.986 . . . . 0.0 110.088 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 56.6 m95 -105.98 129.6 54.07 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.194 -0.941 . . . . 0.0 109.949 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -112.41 177.11 4.75 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.21 -0.931 . . . . 0.0 111.162 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.447 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -94.69 -170.68 2.29 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.519 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.98 HG22 ' CE1' ' A' ' 93' ' ' HIS . 46.3 mm -88.3 -43.6 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.044 -1.035 . . . . 0.0 108.982 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -21.95 27.27 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.993 -1.067 . . . . 0.0 111.399 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 63.0 m -75.38 -43.68 48.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.683 -1.261 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.2 tpt -73.59 -39.33 64.7 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.733 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.666 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 10.1 m-85 -73.32 -30.21 63.21 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.967 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.42 -36.83 82.03 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.927 -1.108 . . . . 0.0 109.403 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -58.5 -38.64 78.09 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.991 -1.068 . . . . 0.0 109.888 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.2 -41.33 86.0 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.746 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -67.01 -33.58 75.87 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.3 -0.875 . . . . 0.0 110.647 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 18.2 ttt85 -86.5 -35.88 19.34 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.12 -0.988 . . . . 0.0 110.42 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.83 0 O-C-N 121.045 -1.034 . . . . 0.0 110.061 179.873 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt . . . . . 0 N--CA 1.493 1.708 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.778 HG12 HD11 ' A' ' 76' ' ' LEU . 77.5 mt 52.84 94.71 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.048 -1.033 . . . . 0.0 110.589 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -115.22 135.4 54.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.966 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 53.46 -165.25 0.08 Allowed 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.1 -1.0 . . . . 0.0 110.542 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.551 HD13 ' HB ' ' A' ' 91' ' ' THR . 8.3 tt -103.68 -48.12 4.04 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.171 -0.955 . . . . 0.0 110.354 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.31 69.62 4.54 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.125 -0.985 . . . . 0.0 109.817 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -143.49 -58.6 0.41 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.267 -0.896 . . . . 0.0 110.07 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.778 HD11 HG12 ' A' ' 70' ' ' ILE . 94.3 mt -62.52 151.59 37.12 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.163 -0.961 . . . . 0.0 109.564 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -79.94 128.84 33.95 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.184 -0.948 . . . . 0.0 110.262 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 143.71 -47.62 0.78 Allowed Glycine 0 N--CA 1.494 2.505 0 C-N-CA 119.753 -1.213 . . . . 0.0 110.588 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.45 ' HA ' HD12 ' A' ' 82' ' ' LEU . 45.9 p-90 -51.7 -30.54 22.51 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.917 -1.343 . . . . 0.0 111.216 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 5.8 tp10 -53.76 -27.91 31.45 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.963 -1.086 . . . . 0.0 111.332 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -111.74 26.95 10.11 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.821 -1.174 . . . . 0.0 112.064 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.622 HD13 ' CD2' ' A' ' 10' ' ' TYR . 29.9 mt -108.81 -164.27 0.93 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.812 -1.18 . . . . 0.0 109.555 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -94.98 161.89 13.96 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.957 -1.09 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -76.36 -47.9 21.79 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.238 -0.914 . . . . 0.0 109.999 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.3 -41.65 93.88 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.236 -0.915 . . . . 0.0 109.594 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 15.3 mt-10 -59.46 -39.98 85.4 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.291 -0.881 . . . . 0.0 109.628 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.871 ' HA ' HD12 ' A' ' 90' ' ' ILE . 3.6 ttpp -56.39 -39.23 72.63 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.207 -0.933 . . . . 0.0 109.97 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.536 ' O ' HG22 ' A' ' 91' ' ' THR . 3.1 tt0 -57.88 -37.92 74.82 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.263 -0.898 . . . . 0.0 109.961 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -70.07 -33.72 72.28 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.122 -0.986 . . . . 0.0 110.031 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 87' ' ' LYS . 11.9 mt -70.37 -38.64 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.11 -0.994 . . . . 0.0 110.003 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.551 ' HB ' HD13 ' A' ' 73' ' ' LEU . 9.5 t -69.04 -32.42 71.9 Favored 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 118.913 -1.115 . . . . 0.0 110.276 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.58 -39.89 70.29 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.992 -1.067 . . . . 0.0 108.781 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.98 ' CE1' HG22 ' A' ' 53' ' ' ILE . 70.0 t60 -56.27 -43.79 79.12 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.268 -0.895 . . . . 0.0 109.721 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.468 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 58.0 mt -67.94 -39.68 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.905 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.43 85.12 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.16 -0.963 . . . . 0.0 109.681 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.35 -42.29 95.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.16 -0.963 . . . . 0.0 109.377 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.4 HD22 ' HD1' ' A' ' 57' ' ' PHE . 5.6 tp -66.07 -35.86 81.65 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.297 -0.877 . . . . 0.0 109.859 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 73.6 m -105.09 58.6 0.68 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.156 -0.965 . . . . 0.0 109.971 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.091 -1.006 . . . . 0.0 110.283 -179.934 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 . . . . . 0 N--CA 1.496 1.847 0 CA-C-O 120.655 0.264 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -139.69 131.85 28.09 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.235 -0.916 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.808 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.1 m-85 -125.4 139.95 53.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.166 -0.959 . . . . 0.0 110.25 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.5 m -127.39 163.19 24.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.921 . . . . 0.0 108.871 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.643 HG12 HG23 ' A' ' 32' ' ' ILE . 29.2 m -133.76 133.29 56.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.95 -1.094 . . . . 0.0 110.753 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -139.3 155.28 47.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.307 -0.871 . . . . 0.0 109.989 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -102.11 143.15 32.29 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.31 -0.869 . . . . 0.0 109.884 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.31 138.38 56.47 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.156 -0.965 . . . . 0.0 110.146 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mttt -130.05 -59.8 1.04 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 110.334 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.01 93.31 2.38 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.199 -0.938 . . . . 0.0 110.422 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.9 142.97 4.23 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.525 HG22 ' HA ' ' A' ' 26' ' ' VAL . 29.8 p -114.69 147.01 40.24 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.259 -1.142 . . . . 0.0 109.921 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.62 147.79 38.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.089 -1.007 . . . . 0.0 111.003 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.94 124.88 18.23 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.1 t -61.36 131.05 49.03 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.221 -1.164 . . . . 0.0 109.344 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm -62.22 148.17 45.57 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.156 -0.965 . . . . 0.0 109.269 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttt 52.45 47.42 24.75 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.972 -1.08 . . . . 0.0 109.673 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.3 t -164.8 153.03 12.06 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.31 -0.869 . . . . 0.0 110.895 -178.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 tttm -103.84 46.96 0.89 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -142.05 -174.37 4.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.404 -0.81 . . . . 0.0 110.197 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -133.2 156.27 47.82 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.222 -0.924 . . . . 0.0 109.727 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.731 HG21 ' HD3' ' A' ' 31' ' ' ARG . 62.2 mt -96.35 113.04 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.81 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.525 ' HA ' HG22 ' A' ' 15' ' ' THR . 67.9 t -108.51 162.78 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -41.44 133.15 2.59 Favored 'General case' 0 N--CA 1.519 3.02 0 O-C-N 121.689 -0.632 . . . . 0.0 111.527 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.8 4.31 45.61 Favored Glycine 0 N--CA 1.493 2.453 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.084 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.424 ' CG1' HG23 ' A' ' 25' ' ' ILE . 89.3 t -115.11 134.79 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-N 119.582 1.691 . . . . 0.0 109.546 179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.706 ' HB3' HD11 ' A' ' 53' ' ' ILE . 44.9 t -85.39 134.41 34.08 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.169 -0.957 . . . . 0.0 108.933 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.731 ' HD3' HG21 ' A' ' 25' ' ' ILE . 46.1 mtm105 -115.43 135.48 54.07 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.177 -0.952 . . . . 0.0 111.275 -178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.643 HG23 HG12 ' A' ' 8' ' ' VAL . 12.9 mt -104.7 129.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 178.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.1 131.71 10.7 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 22.7 tttt -110.78 113.45 26.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.327 -1.102 . . . . 0.0 109.566 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.73 107.62 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.148 -0.97 . . . . 0.0 110.198 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.407 HG13 ' O ' ' A' ' 36' ' ' VAL . 7.2 p -124.08 127.17 25.45 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.282 -0.886 . . . . 0.0 110.193 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.63 139.05 27.62 Favored 'Trans proline' 0 C--N 1.319 -0.983 0 O-C-N 123.088 1.046 . . . . 0.0 110.514 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.061 0 O-C-N 121.285 -0.885 . . . . 0.0 109.95 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.499 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -130.82 146.59 52.31 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.193 -1.18 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.2 ttm -115.66 149.08 38.93 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.191 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -129.23 148.75 51.2 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.552 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.47 155.28 48.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.57 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 71.0 m95 -98.13 156.87 16.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.122 -0.986 . . . . 0.0 110.157 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -136.15 172.99 12.2 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.317 -0.864 . . . . 0.0 110.546 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 0.3 OUTLIER -91.72 -170.42 2.58 Favored 'General case' 0 N--CA 1.504 2.232 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.585 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.706 HD11 ' HB3' ' A' ' 30' ' ' CYS . 42.1 mm -83.89 -60.02 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.161 179.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.7 mmtt -73.82 -27.42 61.11 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.927 -1.108 . . . . 0.0 111.262 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 52' ' ' HIS . 84.5 m -65.87 -51.47 58.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 120.741 -1.224 . . . . 0.0 110.253 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.671 ' HE1' HD11 ' A' ' 70' ' ' ILE . 0.6 OUTLIER -70.05 -39.55 75.65 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.814 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.458 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 8.6 m-85 -71.85 -28.56 63.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.2 -1.0 . . . . 0.0 109.944 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -67.38 -37.01 82.48 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.789 -1.194 . . . . 0.0 109.43 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -58.58 -40.49 83.29 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.023 -1.048 . . . . 0.0 109.755 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.22 -42.17 98.14 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.227 -0.921 . . . . 0.0 109.129 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -56.71 -33.83 66.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.152 -0.968 . . . . 0.0 109.67 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.8 mtt-85 -103.35 29.84 5.34 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.215 -0.928 . . . . 0.0 110.497 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.883 0 O-C-N 120.882 -1.136 . . . . 0.0 109.976 179.805 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 120.637 0.256 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.671 HD11 ' HE1' ' A' ' 56' ' ' MET . 83.4 mt 54.54 101.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.949 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -110.23 141.17 43.55 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.158 -0.964 . . . . 0.0 109.789 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.6 t0 53.41 -169.9 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.035 -1.041 . . . . 0.0 110.416 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.536 ' HB2' HG23 ' A' ' 91' ' ' THR . 18.7 tp -118.52 38.58 3.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.105 -0.997 . . . . 0.0 110.648 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 35.98 0.82 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.132 -0.98 . . . . 0.0 110.55 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -131.43 29.45 4.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.201 -0.937 . . . . 0.0 110.559 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.808 HD22 ' HB3' ' A' ' 6' ' ' PHE . 96.4 mt -137.46 153.57 50.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.045 -1.034 . . . . 0.0 109.401 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.8 102.24 11.47 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.07 -1.018 . . . . 0.0 110.393 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.93 -39.11 0.6 Allowed Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.674 -1.25 . . . . 0.0 111.105 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.403 ' N ' ' CG2' ' A' ' 8' ' ' VAL . 46.6 p-90 -57.26 -32.17 66.32 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.832 -1.393 . . . . 0.0 110.913 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -53.26 -34.27 56.5 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.832 -1.167 . . . . 0.0 110.612 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.86 -36.06 31.89 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.999 -1.063 . . . . 0.0 110.295 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.02 176.91 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.965 -1.084 . . . . 0.0 110.66 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -104.02 160.4 14.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.078 -1.014 . . . . 0.0 110.406 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -60.44 -46.01 91.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.238 -0.914 . . . . 0.0 110.086 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -61.56 -48.04 82.79 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.553 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -64.66 -40.59 95.69 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.429 -0.909 . . . . 0.0 109.197 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.408 ' O ' ' OG1' ' A' ' 91' ' ' THR . 12.5 tttm -62.3 -38.9 91.17 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.347 -0.846 . . . . 0.0 109.911 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.07 -41.12 97.84 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.196 -0.94 . . . . 0.0 109.893 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -66.89 -38.04 85.53 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.244 -0.91 . . . . 0.0 110.081 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.14 -38.5 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.124 -0.985 . . . . 0.0 109.338 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.536 HG23 ' HB2' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -59.24 -39.03 81.47 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.135 -0.978 . . . . 0.0 109.811 179.472 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -56.02 -36.76 68.33 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.063 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.681 ' CE1' HG22 ' A' ' 53' ' ' ILE . 0.3 OUTLIER -58.82 -51.61 69.26 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.677 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.458 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.2 mt -60.79 -37.59 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.225 -0.922 . . . . 0.0 109.704 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.09 86.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.168 -0.957 . . . . 0.0 109.62 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.37 -43.35 77.56 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.232 -0.917 . . . . 0.0 108.791 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.73 -35.06 79.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.315 -0.865 . . . . 0.0 109.77 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.3 m -100.62 66.59 1.23 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.981 -1.074 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.126 -0.984 . . . . 0.0 110.177 179.997 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 . . . . . 0 N--CA 1.496 1.829 0 CA-C-O 120.723 0.296 . . . . 0.0 110.337 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.2 137.86 31.08 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.217 -0.927 . . . . 0.0 110.191 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.718 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -117.25 142.13 47.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.9 m -130.51 165.0 23.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.262 -0.899 . . . . 0.0 109.314 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.8 m -130.64 139.83 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.066 -1.022 . . . . 0.0 110.641 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.02 107.66 4.12 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.239 -0.913 . . . . 0.0 110.35 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.791 ' CD2' HD13 ' A' ' 82' ' ' LEU . 10.5 m-85 -58.9 153.03 18.13 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.162 -0.961 . . . . 0.0 110.054 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.75 136.55 48.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.309 -0.869 . . . . 0.0 110.311 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -120.16 -57.34 1.94 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.253 -0.904 . . . . 0.0 110.306 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -128.24 122.99 33.06 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.097 -1.002 . . . . 0.0 110.161 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.98 170.88 11.96 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.815 HG23 ' CG1' ' A' ' 26' ' ' VAL . 57.4 m -140.98 135.44 31.17 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.18 -1.188 . . . . 0.0 110.126 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.44 137.17 26.8 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.16 -0.963 . . . . 0.0 110.734 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.6 123.21 15.73 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.6 t -62.37 130.9 47.39 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.246 -1.15 . . . . 0.0 109.46 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -62.41 147.33 48.89 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.117 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? 52.5 48.21 23.06 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.02 -1.05 . . . . 0.0 109.579 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -164.93 153.3 12.04 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.401 -0.812 . . . . 0.0 110.852 -178.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -104.05 46.27 0.92 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -143.28 -174.63 4.26 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.498 -0.751 . . . . 0.0 110.077 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -136.16 155.5 50.06 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.112 -0.993 . . . . 0.0 109.727 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.604 HG23 HG11 ' A' ' 29' ' ' VAL . 59.5 mt -103.86 118.29 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.303 -0.873 . . . . 0.0 109.709 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.815 ' CG1' HG23 ' A' ' 15' ' ' THR . 29.7 m -137.48 89.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.106 -0.996 . . . . 0.0 111.251 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 tttm 60.3 149.45 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.081 -1.012 . . . . 0.0 111.318 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.13 9.18 80.25 Favored Glycine 0 N--CA 1.496 2.678 0 C-N-CA 120.245 -0.978 . . . . 0.0 111.712 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.604 HG11 HG23 ' A' ' 25' ' ' ILE . 80.1 t -127.6 135.17 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-N 119.712 1.756 . . . . 0.0 110.247 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.781 ' HB3' HD11 ' A' ' 53' ' ' ILE . 5.7 t -87.47 120.96 29.3 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.592 ' HD3' HG21 ' A' ' 25' ' ' ILE . 44.6 mtm180 -101.69 129.8 47.93 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.939 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.442 HD12 ' HG2' ' A' ' 56' ' ' MET . 18.9 mt -103.82 131.06 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.13 126.0 8.77 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.419 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 40.4 tttt -107.48 116.99 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.289 -1.124 . . . . 0.0 109.741 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.87 111.96 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.097 -1.002 . . . . 0.0 110.106 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 73.7 t -120.37 113.64 33.63 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.247 -0.908 . . . . 0.0 109.794 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.35 147.24 46.76 Favored 'Trans proline' 0 N--CA 1.485 1.018 0 O-C-N 123.202 1.106 . . . . 0.0 110.47 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.5 2.053 0 O-C-N 121.327 -0.858 . . . . 0.0 110.233 179.846 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.467 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -122.02 143.29 49.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.198 -1.177 . . . . 0.0 110.271 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -117.15 129.66 56.11 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.244 -0.91 . . . . 0.0 110.26 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -122.99 136.0 54.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -139.76 155.8 47.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.131 -0.981 . . . . 0.0 109.923 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 51.8 m95 -98.11 163.01 12.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.185 -0.947 . . . . 0.0 110.138 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -143.66 172.69 12.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.265 -0.897 . . . . 0.0 110.683 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 1.9 m80 -91.71 -172.07 3.09 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.954 HG22 ' CE1' ' A' ' 93' ' ' HIS . 44.6 mm -83.38 -47.1 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 C-N-CA 119.117 -1.033 . . . . 0.0 109.047 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.7 mtmt -80.22 -32.89 38.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.798 -1.189 . . . . 0.0 110.717 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 70.8 m -62.67 -50.92 69.28 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.939 -1.101 . . . . 0.0 110.235 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.442 ' HG2' HD12 ' A' ' 32' ' ' ILE . 10.0 tpt -68.0 -42.22 81.08 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.842 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.65 ' HD1' HD22 ' A' ' 97' ' ' LEU . 9.8 m-85 -69.27 -30.71 68.88 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.647 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.61 -37.82 85.36 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.962 -1.086 . . . . 0.0 109.417 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -58.18 -39.19 78.26 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.027 -1.046 . . . . 0.0 109.903 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.7 mp -58.1 -41.78 84.28 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.154 -0.966 . . . . 0.0 109.346 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -57.95 -34.12 69.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.236 -0.915 . . . . 0.0 109.589 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -104.4 30.46 5.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.196 -0.94 . . . . 0.0 110.525 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.021 0 O-C-N 120.892 -1.13 . . . . 0.0 110.071 179.786 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.576 HG23 HD11 ' A' ' 76' ' ' LEU . 73.4 mt 54.97 99.21 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 O-C-N 121.126 -0.984 . . . . 0.0 110.469 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -109.49 139.91 43.9 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.156 -0.965 . . . . 0.0 110.31 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.17 -176.73 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.092 -1.005 . . . . 0.0 110.896 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.871 HD11 HG23 ' A' ' 90' ' ' ILE . 15.0 tp -98.73 -29.65 12.89 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.25 42.88 1.08 Allowed 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.779 -1.201 . . . . 0.0 110.404 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -122.06 34.7 5.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.142 -0.974 . . . . 0.0 110.192 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 6' ' ' PHE . 57.3 mt -145.8 153.71 41.22 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.05 -1.031 . . . . 0.0 109.963 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -85.13 116.37 23.46 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.046 -1.034 . . . . 0.0 110.442 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 148.49 -40.92 0.9 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.744 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.403 ' HA ' HD12 ' A' ' 82' ' ' LEU . 48.9 p-90 -61.93 -26.1 67.98 Favored 'General case' 0 N--CA 1.513 2.684 0 O-C-N 121.069 -1.253 . . . . 0.0 111.538 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -53.05 -28.04 22.75 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 120.788 -1.195 . . . . 0.0 111.465 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -112.77 28.45 8.78 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.809 -1.182 . . . . 0.0 112.116 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.791 HD13 ' CD2' ' A' ' 10' ' ' TYR . 25.8 mt -109.76 -166.1 1.07 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.714 -1.242 . . . . 0.0 109.918 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -97.74 162.83 13.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.101 -0.999 . . . . 0.0 110.333 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -81.96 -39.89 23.02 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.212 -0.93 . . . . 0.0 110.306 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -61.85 -50.54 71.86 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.19 -0.944 . . . . 0.0 109.596 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 10.7 mt-10 -61.75 -41.49 97.73 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.289 -0.882 . . . . 0.0 109.227 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.562 ' O ' HG22 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -59.17 -34.36 72.02 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.259 -0.901 . . . . 0.0 110.208 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.71 -35.3 76.99 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.053 -1.029 . . . . 0.0 110.236 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.04 -41.32 77.81 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.969 -1.082 . . . . 0.0 110.201 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.871 HG23 HD11 ' A' ' 73' ' ' LEU . 4.5 tt -65.04 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.223 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.858 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -65.4 -40.01 92.92 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.846 -1.159 . . . . 0.0 109.317 178.924 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -35.33 63.56 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.277 -0.89 . . . . 0.0 110.247 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.954 ' CE1' HG22 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -56.8 -47.29 80.55 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 121.037 -1.04 . . . . 0.0 109.922 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.453 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 16.6 mt -63.63 -37.48 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.114 -0.991 . . . . 0.0 109.724 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.09 -39.56 95.08 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.144 -0.973 . . . . 0.0 109.664 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.13 -36.8 69.5 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.2 -0.937 . . . . 0.0 109.801 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.65 HD22 ' HD1' ' A' ' 57' ' ' PHE . 8.2 tp -79.76 -30.95 40.88 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.179 -0.951 . . . . 0.0 110.584 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 66.9 m -93.08 -38.14 11.78 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.835 -1.165 . . . . 0.0 110.349 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.497 1.904 0 O-C-N 121.127 -0.983 . . . . 0.0 110.157 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 . . . . . 0 N--CA 1.495 1.813 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -123.64 125.95 45.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.191 -0.943 . . . . 0.0 110.414 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.693 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -116.72 137.39 52.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.264 -0.898 . . . . 0.0 109.894 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.4 t -125.89 154.34 42.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 109.138 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.803 HG12 HG23 ' A' ' 32' ' ' ILE . 28.9 m -129.44 143.33 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.954 -1.091 . . . . 0.0 110.326 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -158.22 138.15 12.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.185 -0.947 . . . . 0.0 110.986 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.461 ' OH ' ' HB2' ' A' ' 86' ' ' GLU . 1.7 m-85 -53.53 155.73 2.86 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 121.093 -1.004 . . . . 0.0 110.424 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.479 ' CB ' HG22 ' A' ' 25' ' ' ILE . . . -88.17 150.98 23.01 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 119.535 -0.866 . . . . 0.0 109.652 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -105.05 -163.64 0.97 Allowed 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.16 -0.963 . . . . 0.0 110.337 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -89.51 61.24 5.48 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.159 -0.963 . . . . 0.0 110.037 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.764 ' O ' HG22 ' A' ' 26' ' ' VAL . . . -130.27 -164.88 11.45 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.315 -1.514 . . . . 0.0 109.315 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 p -117.94 110.81 18.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.299 -1.118 . . . . 0.0 110.012 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.51 99.35 5.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.129 -0.982 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.36 119.29 13.85 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.0 t -59.79 128.94 39.41 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.195 -1.18 . . . . 0.0 109.83 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -62.2 148.76 43.65 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.111 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt 52.71 45.05 29.45 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.991 -1.068 . . . . 0.0 109.647 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.4 t -164.74 153.45 12.6 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.35 -0.844 . . . . 0.0 110.742 -178.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.89 48.4 0.86 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.261 -0.899 . . . . 0.0 108.582 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -144.48 -174.65 4.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.467 -0.77 . . . . 0.0 110.286 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.85 157.08 44.95 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.186 -0.946 . . . . 0.0 109.871 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.733 HG23 ' HB ' ' A' ' 29' ' ' VAL . 38.3 mt -110.56 113.51 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 109.579 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.764 HG22 ' O ' ' A' ' 14' ' ' GLY . 62.1 t -134.33 90.19 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.06 -1.025 . . . . 0.0 110.569 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.87 134.6 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.348 -0.845 . . . . 0.0 111.194 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.96 -24.12 33.6 Favored Glycine 0 N--CA 1.495 2.601 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.19 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.733 ' HB ' HG23 ' A' ' 25' ' ' ILE . 57.9 t -114.38 136.95 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 CA-C-N 119.262 1.531 . . . . 0.0 110.373 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.27 139.5 39.84 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.4 -0.92 . . . . 0.0 108.851 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HG2' HG21 ' A' ' 25' ' ' ILE . 44.0 mtm-85 -107.82 137.28 46.1 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.109 -0.995 . . . . 0.0 110.811 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.803 HG23 HG12 ' A' ' 8' ' ' VAL . 4.5 mt -109.01 125.13 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.6 122.28 7.46 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.656 -1.377 . . . . 0.0 109.656 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.448 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.6 ttpm? -104.45 113.07 26.39 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.414 -1.05 . . . . 0.0 109.469 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.0 t -97.45 107.21 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.174 -0.954 . . . . 0.0 110.04 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.434 HG23 ' HD2' ' A' ' 37' ' ' PRO . 9.7 p -124.66 143.27 42.99 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.434 ' HD2' HG23 ' A' ' 36' ' ' VAL . 47.8 Cg_endo -74.03 151.55 44.82 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 O-C-N 123.209 1.11 . . . . 0.0 110.412 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 . . . . . 0 N--CA 1.5 2.034 0 O-C-N 121.303 -0.873 . . . . 0.0 110.102 179.811 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.576 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -108.48 146.58 32.96 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.202 -1.175 . . . . 0.0 110.004 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.3 mtt -115.62 144.49 43.83 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.574 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -123.1 129.63 51.72 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.265 -0.897 . . . . 0.0 109.99 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -125.26 159.31 31.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.152 -0.968 . . . . 0.0 110.209 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.418 ' CE3' ' HB3' ' A' ' 31' ' ' ARG . 72.5 m95 -104.31 134.13 48.05 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.241 -0.912 . . . . 0.0 110.017 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -116.25 173.0 6.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.255 -0.903 . . . . 0.0 110.714 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.618 ' HD2' HG11 ' A' ' 29' ' ' VAL . 1.1 m170 -93.26 -171.79 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.986 HG22 ' CE1' ' A' ' 93' ' ' HIS . 49.3 mm -85.63 -45.0 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 C-N-CA 118.943 -1.103 . . . . 0.0 109.004 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -21.66 29.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.042 -1.037 . . . . 0.0 111.341 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 59.5 m -78.24 -41.69 33.5 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.753 -1.217 . . . . 0.0 109.759 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.35 -38.15 60.25 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.743 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.684 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 11.4 m-85 -71.76 -30.22 65.35 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.677 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -61.16 -37.01 81.36 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.921 -1.112 . . . . 0.0 109.497 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -58.87 -40.08 83.28 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.029 -1.044 . . . . 0.0 109.826 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.406 ' HB3' HD21 ' A' ' 97' ' ' LEU . 9.4 mp -58.96 -42.93 91.07 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.187 -0.946 . . . . 0.0 109.305 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -57.74 -34.14 69.2 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.296 -0.878 . . . . 0.0 109.68 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.05 29.68 5.75 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.212 -0.93 . . . . 0.0 110.589 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.886 0 O-C-N 120.882 -1.136 . . . . 0.0 109.971 179.77 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.9 mttt . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 120.806 0.336 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 76' ' ' LEU . 79.0 mt 53.6 96.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.162 -0.961 . . . . 0.0 110.76 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -115.69 133.06 56.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.135 -0.978 . . . . 0.0 109.936 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 51.49 -172.9 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.076 -1.015 . . . . 0.0 110.735 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.815 HD13 HG21 ' A' ' 90' ' ' ILE . 50.4 tp -117.19 84.33 2.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.134 -0.979 . . . . 0.0 110.397 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -171.91 -51.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.17 -0.956 . . . . 0.0 110.744 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -51.0 -30.87 16.34 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.113 -0.992 . . . . 0.0 111.23 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.693 HD22 ' HB3' ' A' ' 6' ' ' PHE . 30.8 mt -74.73 153.87 38.65 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.919 -1.113 . . . . 0.0 109.964 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -99.38 119.05 37.34 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.198 -0.939 . . . . 0.0 111.065 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.83 -38.81 1.46 Allowed Glycine 0 N--CA 1.495 2.567 0 N-CA-C 110.266 -1.133 . . . . 0.0 110.266 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.418 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 59.7 p-90 -51.39 -34.91 36.53 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.017 -1.284 . . . . 0.0 110.937 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.418 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 6.4 tt0 -54.79 -35.9 64.33 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.982 -1.074 . . . . 0.0 110.565 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -80.54 -36.8 32.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.034 -1.041 . . . . 0.0 110.286 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.49 HD23 ' HG3' ' A' ' 86' ' ' GLU . 7.2 mp -48.9 172.74 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.131 -0.98 . . . . 0.0 111.206 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -105.11 163.2 12.74 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.212 -0.93 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -52.42 -39.42 60.97 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.179 -0.95 . . . . 0.0 110.798 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.97 -52.13 65.28 Favored 'General case' 0 N--CA 1.508 2.455 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.635 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.49 ' HG3' HD23 ' A' ' 82' ' ' LEU . 14.0 tp10 -64.09 -40.97 97.38 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.435 -0.906 . . . . 0.0 109.065 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.539 ' HG3' HD21 ' A' ' 73' ' ' LEU . 33.3 tttt -63.99 -39.39 94.0 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.694 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.33 -40.73 97.31 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.58 -37.81 88.85 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.06 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.815 HG21 HD13 ' A' ' 73' ' ' LEU . 42.0 mm -64.86 -41.73 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 47.2 p -63.16 -47.08 84.19 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.426 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -64.25 -40.56 96.26 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.981 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.986 ' CE1' HG22 ' A' ' 53' ' ' ILE . 64.6 t60 -61.15 -43.55 98.7 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.435 HG12 ' CE2' ' A' ' 57' ' ' PHE . 19.1 mt -70.44 -38.72 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 O-C-N 121.159 -0.963 . . . . 0.0 108.839 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.09 91.29 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.137 -0.977 . . . . 0.0 109.375 178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.77 -37.0 80.38 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.165 -0.959 . . . . 0.0 109.829 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.561 HD22 ' HD2' ' A' ' 57' ' ' PHE . 5.0 tp -88.07 -33.33 18.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.401 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.3 m -102.17 54.51 0.8 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.945 -1.097 . . . . 0.0 110.206 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.494 1.769 0 O-C-N 121.178 -0.951 . . . . 0.0 110.22 179.881 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 . . . . . 0 N--CA 1.494 1.738 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 mmt-85 -116.29 134.17 55.2 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.232 -0.917 . . . . 0.0 110.039 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.649 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.3 m-85 -116.99 144.99 43.94 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.169 -0.957 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.0 t -131.56 153.09 50.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.351 -0.843 . . . . 0.0 108.952 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.523 HG12 HG23 ' A' ' 32' ' ' ILE . 24.2 m -126.95 132.0 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 O-C-N 120.994 -1.066 . . . . 0.0 110.568 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -147.68 159.63 43.57 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.087 -1.008 . . . . 0.0 110.561 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.407 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -100.41 155.74 17.65 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.453 -0.78 . . . . 0.0 109.968 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.552 ' HB2' ' NE ' ' A' ' 31' ' ' ARG . . . -107.61 138.68 43.39 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.361 -0.837 . . . . 0.0 110.292 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 tttt -150.23 127.73 11.51 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.248 -0.907 . . . . 0.0 110.605 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 ttt85 54.71 99.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.093 -1.004 . . . . 0.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.869 ' O ' HG21 ' A' ' 26' ' ' VAL . . . 144.86 -151.41 23.55 Favored Glycine 0 N--CA 1.496 2.665 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.622 HG23 ' O ' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -158.02 138.44 12.72 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.195 -1.179 . . . . 0.0 110.593 -179.882 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.98 107.16 4.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.157 -0.964 . . . . 0.0 110.539 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.67 114.72 7.13 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.451 ' CB ' HD11 ' A' ' 25' ' ' ILE . 24.6 t -61.06 128.49 36.71 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.207 -1.172 . . . . 0.0 109.521 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.426 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 19.1 tptt -61.8 148.09 44.27 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.196 -0.94 . . . . 0.0 109.091 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.3 mttt 52.74 45.62 28.35 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.946 -1.096 . . . . 0.0 109.669 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.8 t -165.21 154.08 12.21 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.362 -0.836 . . . . 0.0 110.783 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -105.5 44.04 1.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -141.43 -177.11 4.99 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.015 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -126.71 161.68 27.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.019 -1.051 . . . . 0.0 110.264 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.93 HG23 ' CG1' ' A' ' 29' ' ' VAL . 7.1 mt -120.17 102.92 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.409 -0.807 . . . . 0.0 109.997 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.869 HG21 ' O ' ' A' ' 14' ' ' GLY . 9.5 p -162.32 143.93 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.24 -0.913 . . . . 0.0 111.266 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.9 tptp 52.84 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.261 -0.9 . . . . 0.0 111.558 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.51 9.31 83.59 Favored Glycine 0 N--CA 1.496 2.652 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.061 179.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.93 ' CG1' HG23 ' A' ' 25' ' ' ILE . 58.9 t -124.49 135.14 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 119.891 1.846 . . . . 0.0 110.582 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.637 ' HB3' HD11 ' A' ' 53' ' ' ILE . 43.4 t -102.0 140.01 36.87 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.301 -0.875 . . . . 0.0 108.767 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.842 ' HB3' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -129.23 150.33 50.65 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.124 -0.985 . . . . 0.0 111.401 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.523 HG23 HG12 ' A' ' 8' ' ' VAL . 19.2 mt -110.81 138.27 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.444 -0.785 . . . . 0.0 108.997 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.12 125.89 8.56 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.165 -1.574 . . . . 0.0 109.165 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.431 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 22.0 ttmt -107.51 120.54 42.47 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.238 -1.154 . . . . 0.0 109.804 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.5 t -101.63 107.5 21.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.058 -1.026 . . . . 0.0 110.28 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.444 HG23 ' HD2' ' A' ' 37' ' ' PRO . 8.4 p -124.66 143.5 43.66 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.444 ' HD2' HG23 ' A' ' 36' ' ' VAL . 46.6 Cg_endo -72.96 126.36 11.2 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 O-C-N 123.089 1.047 . . . . 0.0 110.228 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 N--CA 1.5 2.03 0 O-C-N 121.165 -0.959 . . . . 0.0 110.231 179.834 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.466 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -115.78 138.85 50.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.259 -1.142 . . . . 0.0 110.257 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.6 ttt -117.25 143.62 45.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.221 -0.924 . . . . 0.0 110.385 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -117.99 128.51 54.85 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.249 -0.907 . . . . 0.0 110.139 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -122.95 148.59 45.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.21 -0.931 . . . . 0.0 109.777 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 23.4 m95 -94.23 163.25 13.52 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.137 -0.977 . . . . 0.0 109.94 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.426 ' CE1' ' HB3' ' A' ' 19' ' ' LYS . 89.0 m-85 -146.29 174.82 11.01 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.307 -0.871 . . . . 0.0 110.459 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CD2' HG12 ' A' ' 25' ' ' ILE . 1.8 m80 -99.44 -175.79 3.1 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.331 -0.855 . . . . 0.0 108.831 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.929 HG22 ' CE1' ' A' ' 93' ' ' HIS . 49.8 mm -83.98 -34.34 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 O-C-N 121.076 -1.015 . . . . 0.0 109.582 178.661 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -91.38 -32.45 15.65 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.695 -1.253 . . . . 0.0 110.594 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 70.9 m -63.46 -52.38 61.65 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.959 -1.088 . . . . 0.0 110.744 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.411 ' HB2' ' HB3' ' A' ' 51' ' ' TYR . 11.7 tpt -67.76 -38.27 83.23 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.42 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 13.2 m-85 -76.77 -27.0 55.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.015 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -75.21 -37.12 61.27 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.836 -1.165 . . . . 0.0 109.407 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -40.85 82.32 Favored 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.31 179.19 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.854 HD23 HD21 ' A' ' 97' ' ' LEU . 3.8 tp -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.405 -0.809 . . . . 0.0 109.606 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -70.31 -33.32 71.38 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.181 -0.949 . . . . 0.0 110.424 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -30.62 21.31 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.11 -0.994 . . . . 0.0 111.059 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.995 0 O-C-N 120.877 -1.139 . . . . 0.0 110.434 -179.862 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mttp . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 120.749 0.309 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.7 mt 55.69 99.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.179 -0.951 . . . . 0.0 110.538 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.55 143.62 44.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.205 -0.934 . . . . 0.0 110.001 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.26 -172.33 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.093 -1.005 . . . . 0.0 110.423 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.958 HD22 HG23 ' A' ' 91' ' ' THR . 13.2 tp -122.54 37.38 4.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.218 -0.926 . . . . 0.0 110.71 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -144.42 36.56 1.21 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.085 -1.01 . . . . 0.0 110.404 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -134.98 33.53 3.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.245 -0.909 . . . . 0.0 110.101 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.649 HD22 ' HB3' ' A' ' 6' ' ' PHE . 55.2 mt -138.91 156.36 47.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.093 -1.004 . . . . 0.0 109.729 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -86.55 104.66 16.2 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.167 -0.958 . . . . 0.0 110.875 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.97 -30.12 2.28 Favored Glycine 0 N--CA 1.495 2.604 0 C-N-CA 119.519 -1.324 . . . . 0.0 111.806 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.424 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 19.0 p-90 -57.65 -34.23 69.13 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 119.492 1.646 . . . . 0.0 110.761 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.424 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 23.5 tt0 -55.78 -35.61 66.46 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.943 -1.098 . . . . 0.0 110.487 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -74.49 -32.77 62.65 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.03 -1.044 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.8 174.44 0.02 OUTLIER 'General case' 0 N--CA 1.519 2.979 0 O-C-N 120.971 -1.081 . . . . 0.0 110.913 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -105.43 161.77 14.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.175 -0.953 . . . . 0.0 110.452 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.54 -50.12 74.91 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.226 -0.921 . . . . 0.0 110.347 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -61.18 -37.2 82.06 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.238 -0.914 . . . . 0.0 110.203 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.407 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 55.4 mt-10 -73.27 -41.22 63.88 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.132 -0.98 . . . . 0.0 108.805 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.478 ' O ' HG22 ' A' ' 90' ' ' ILE . 34.7 tttt -58.89 -34.86 72.13 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.372 -0.83 . . . . 0.0 109.949 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -65.13 -35.6 81.62 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.091 -1.006 . . . . 0.0 109.987 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -67.51 -47.31 70.33 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.981 -1.074 . . . . 0.0 110.083 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.478 HG22 ' O ' ' A' ' 87' ' ' LYS . 18.2 tt -63.98 -34.43 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.437 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.823 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.958 HG23 HD22 ' A' ' 73' ' ' LEU . 0.8 OUTLIER -63.35 -39.38 94.39 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.912 -1.117 . . . . 0.0 109.179 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -55.77 -38.63 70.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.141 -0.974 . . . . 0.0 109.969 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.929 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.4 m-70 -60.69 -53.33 58.69 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.196 -0.94 . . . . 0.0 109.837 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.449 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.6 mt -61.94 -38.73 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.484 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.24 93.18 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.156 -0.965 . . . . 0.0 109.508 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.53 -43.4 76.82 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.234 -0.916 . . . . 0.0 108.797 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.854 HD21 HD23 ' A' ' 60' ' ' LEU . 13.6 tp -60.56 -34.97 74.94 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.282 -0.886 . . . . 0.0 109.962 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.7 m -98.14 50.91 1.02 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.088 -1.007 . . . . 0.0 110.116 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 9.5 t . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.125 -0.985 . . . . 0.0 110.056 -179.957 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 . . . . . 0 N--CA 1.497 1.922 0 CA-C-O 120.615 0.245 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -125.08 143.99 50.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.208 -0.933 . . . . 0.0 110.165 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.539 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.7 m-85 -118.78 149.57 41.27 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.289 -0.882 . . . . 0.0 110.209 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.437 ' O ' HG23 ' A' ' 32' ' ' ILE . 10.4 m -135.41 164.81 26.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.254 -0.904 . . . . 0.0 109.421 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.466 ' HB ' HD23 ' A' ' 76' ' ' LEU . 3.9 p -139.29 112.87 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.053 -1.03 . . . . 0.0 110.231 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -125.77 142.97 51.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 109.699 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.454 ' CD1' ' HB3' ' A' ' 82' ' ' LEU . 95.9 m-85 -99.6 137.75 37.65 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.229 -0.919 . . . . 0.0 109.667 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.58 134.66 46.72 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.043 -1.036 . . . . 0.0 110.742 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 32.4 tttt -119.63 -58.02 1.93 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.239 -0.913 . . . . 0.0 110.014 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -147.82 38.61 0.92 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.219 -0.925 . . . . 0.0 110.513 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -146.92 157.56 27.45 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.471 HG22 ' HA ' ' A' ' 26' ' ' VAL . 75.4 p -140.53 140.73 35.28 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.21 -1.171 . . . . 0.0 110.205 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -161.0 151.12 17.56 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.206 -0.934 . . . . 0.0 111.398 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -54.46 127.02 38.74 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 108.822 -1.711 . . . . 0.0 108.822 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.73 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 23.4 p -64.53 127.9 33.49 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.272 -1.134 . . . . 0.0 110.826 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 1.2 mptm? -75.82 156.51 34.39 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.52 -0.738 . . . . 0.0 109.308 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 tptp 65.89 16.25 10.4 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.904 -1.122 . . . . 0.0 111.529 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.73 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 9.3 p -174.83 149.14 1.14 Allowed 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.572 -1.33 . . . . 0.0 110.646 178.12 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 tttt -85.07 88.84 7.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.986 -1.071 . . . . 0.0 111.776 -177.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.422 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.0 tt0 -166.97 -174.56 2.73 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.277 -0.889 . . . . 0.0 110.408 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.09 152.73 47.63 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.039 -1.038 . . . . 0.0 109.656 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.502 HD13 ' HD3' ' A' ' 31' ' ' ARG . 80.9 mt -105.25 118.82 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.344 -0.847 . . . . 0.0 110.024 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 29' ' ' VAL . 57.2 t -115.65 159.0 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.228 -0.92 . . . . 0.0 109.96 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -49.99 132.94 23.1 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.28 -0.888 . . . . 0.0 110.752 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.37 9.7 40.76 Favored Glycine 0 N--CA 1.494 2.531 0 C-N-CA 120.083 -1.056 . . . . 0.0 111.591 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.8 p -123.65 135.13 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 CA-C-N 119.682 1.741 . . . . 0.0 110.536 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 23.8 p -87.01 141.59 28.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.229 -0.92 . . . . 0.0 110.239 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.502 ' HD3' HD13 ' A' ' 25' ' ' ILE . 2.2 ptt180 -138.85 144.52 39.26 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -0.943 . . . . 0.0 110.349 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.437 HG23 ' O ' ' A' ' 7' ' ' CYS . 12.2 mt -106.51 126.9 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.222 -0.924 . . . . 0.0 109.277 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.0 133.74 11.54 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.251 -1.539 . . . . 0.0 109.251 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.467 ' HE2' HG21 ' A' ' 36' ' ' VAL . 33.0 tttt -103.77 121.83 43.83 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.159 -1.201 . . . . 0.0 109.298 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.97 112.6 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.154 -0.966 . . . . 0.0 110.411 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.467 HG21 ' HE2' ' A' ' 34' ' ' LYS . 65.3 t -120.37 141.4 31.86 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.141 -0.975 . . . . 0.0 109.727 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -74.63 129.64 12.89 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.259 1.137 . . . . 0.0 110.431 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 . . . . . 0 N--CA 1.499 1.991 0 O-C-N 121.149 -0.969 . . . . 0.0 110.107 179.594 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.52 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -107.6 146.96 31.25 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.228 -1.16 . . . . 0.0 110.068 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.4 ttm -117.08 151.51 36.66 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.187 -0.946 . . . . 0.0 110.608 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HD2' ' CZ2' ' A' ' 50' ' ' TRP . 7.8 pttt -131.71 142.7 49.87 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.341 -0.849 . . . . 0.0 109.905 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -120.8 134.23 55.3 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.102 -0.999 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CZ2' ' HD2' ' A' ' 48' ' ' LYS . 17.0 m95 -91.56 114.47 27.01 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.074 -1.016 . . . . 0.0 110.591 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.539 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 0.8 OUTLIER -125.44 171.0 10.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.611 177.803 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -87.74 -173.5 4.34 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.49 -0.756 . . . . 0.0 110.028 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.554 HG22 ' ND1' ' A' ' 93' ' ' HIS . 30.8 mm -84.61 -52.75 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -60.22 -37.85 81.57 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.222 -0.924 . . . . 0.0 109.259 178.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -61.49 -51.29 69.26 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.25 -0.906 . . . . 0.0 109.083 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.42 ' HB2' ' CD1' ' A' ' 51' ' ' TYR . 9.0 tpt -68.94 -44.41 73.1 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.339 -0.851 . . . . 0.0 109.302 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 10.6 m-85 -64.12 -29.72 70.83 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 119.157 -1.017 . . . . 0.0 109.721 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.48 -40.09 85.86 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.989 -1.069 . . . . 0.0 109.391 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -66.22 -40.17 90.1 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.236 -0.915 . . . . 0.0 109.114 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.6 mp -57.8 -42.18 83.65 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.205 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -58.84 -35.65 73.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.221 -0.924 . . . . 0.0 109.53 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -105.23 30.56 5.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.228 -0.92 . . . . 0.0 110.457 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.78 0 O-C-N 121.022 -1.049 . . . . 0.0 110.072 179.967 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 120.692 0.282 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.7 mt 54.49 100.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.079 0 O-C-N 121.197 -0.939 . . . . 0.0 110.804 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -107.02 134.09 50.69 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.126 -0.984 . . . . 0.0 109.577 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 53.83 -163.65 0.1 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.996 -1.065 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.71 HD21 ' HG2' ' A' ' 87' ' ' LYS . 58.1 tp -103.87 73.87 1.19 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.984 -1.073 . . . . 0.0 109.811 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.85 -160.0 0.32 Allowed 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.182 -0.949 . . . . 0.0 110.406 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.609 ' O ' HD12 ' A' ' 76' ' ' LEU . 4.8 mm-40 54.6 38.89 30.7 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.911 -1.118 . . . . 0.0 110.238 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.609 HD12 ' O ' ' A' ' 75' ' ' GLU . 1.1 tp -141.85 150.92 42.22 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.304 -0.873 . . . . 0.0 109.412 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -100.89 104.47 15.68 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.137 -0.977 . . . . 0.0 110.829 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.739 ' CA ' HD12 ' A' ' 82' ' ' LEU . . . 140.78 -37.97 1.61 Allowed Glycine 0 N--CA 1.493 2.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.51 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -62.15 -28.18 69.47 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.931 -1.335 . . . . 0.0 111.022 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -51.42 -32.27 25.87 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.853 -1.154 . . . . 0.0 111.87 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -165.1 50.94 0.11 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.62 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.739 HD12 ' CA ' ' A' ' 78' ' ' GLY . 18.0 mt -118.31 -67.73 0.97 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.842 -1.162 . . . . 0.0 109.604 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.446 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 5.1 tp10 -121.0 127.81 52.12 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.143 -0.973 . . . . 0.0 109.815 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.4 -50.33 6.18 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.079 -1.013 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.49 -46.43 88.49 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.193 -0.942 . . . . 0.0 109.628 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -62.76 -36.92 84.63 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.438 -0.905 . . . . 0.0 109.722 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.885 ' HA ' HD12 ' A' ' 90' ' ' ILE . 19.6 ttpt -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.141 -0.974 . . . . 0.0 109.793 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.61 -41.73 97.87 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.18 -0.95 . . . . 0.0 109.558 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -61.01 -36.2 78.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.234 -0.916 . . . . 0.0 110.181 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.885 HD12 ' HA ' ' A' ' 87' ' ' LYS . 44.9 mt -60.11 -38.04 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.081 -1.012 . . . . 0.0 109.775 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -39.91 86.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 120.905 -1.122 . . . . 0.0 109.771 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -59.66 -38.38 81.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 109.737 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.554 ' ND1' HG22 ' A' ' 53' ' ' ILE . 20.7 m-70 -56.46 -47.18 79.71 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.157 -0.964 . . . . 0.0 110.137 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.481 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.9 mp -64.88 -39.75 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.182 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.38 -40.43 81.39 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.16 -0.962 . . . . 0.0 109.383 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -64.25 -40.17 95.46 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.251 -0.906 . . . . 0.0 109.515 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 97' ' ' LEU . 9.2 tp -71.09 -33.38 70.12 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.247 -0.908 . . . . 0.0 110.233 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 40.3 t -102.76 40.06 1.43 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.047 -1.033 . . . . 0.0 110.171 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 N--CA 1.499 2.016 0 O-C-N 121.177 -0.952 . . . . 0.0 110.842 179.966 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -130.43 148.41 52.24 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.163 -0.961 . . . . 0.0 110.295 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.758 ' HB3' HD22 ' A' ' 76' ' ' LEU . 2.8 m-85 -114.09 153.48 29.4 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.316 -0.865 . . . . 0.0 110.25 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -135.69 124.68 24.24 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.438 -0.789 . . . . 0.0 109.318 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.822 HG12 HG23 ' A' ' 32' ' ' ILE . 20.5 m -101.16 134.57 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 O-C-N 121.222 -0.924 . . . . 0.0 110.736 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -143.89 108.4 4.85 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.558 ' CD2' HD13 ' A' ' 82' ' ' LEU . 11.6 m-85 -56.08 158.85 3.68 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.105 -0.997 . . . . 0.0 110.304 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.32 119.01 32.46 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.363 -0.836 . . . . 0.0 110.007 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -111.14 -53.11 2.74 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.165 -0.96 . . . . 0.0 110.39 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -139.93 96.5 3.07 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.184 -0.947 . . . . 0.0 110.191 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 143.45 122.33 1.66 Allowed Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.65 HG22 ' HA ' ' A' ' 26' ' ' VAL . 75.8 p -115.78 144.2 44.32 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.198 -1.178 . . . . 0.0 109.875 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -154.86 151.49 28.66 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.219 -0.926 . . . . 0.0 111.228 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.98 125.19 32.45 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 108.696 -1.761 . . . . 0.0 108.696 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.685 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 23.8 p -63.85 126.96 29.3 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.198 -1.178 . . . . 0.0 110.892 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.437 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 37.8 mmtt -74.89 156.27 36.57 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.601 -0.687 . . . . 0.0 109.178 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.46 15.54 10.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.938 -1.101 . . . . 0.0 111.601 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.685 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.6 p -174.88 150.39 1.25 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.515 -1.366 . . . . 0.0 110.767 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 89.64 7.88 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.043 -1.036 . . . . 0.0 111.668 -178.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.417 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.0 tt0 -167.02 -173.95 2.51 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.312 -0.867 . . . . 0.0 110.289 178.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -130.05 149.19 51.87 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.074 -1.016 . . . . 0.0 109.819 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.661 HG23 ' CG1' ' A' ' 29' ' ' VAL . 81.2 mt -101.24 120.74 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.194 -0.941 . . . . 0.0 109.711 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.65 ' HA ' HG22 ' A' ' 15' ' ' THR . 59.8 t -108.57 157.02 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.233 -0.917 . . . . 0.0 110.061 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.3 mtpp -51.39 126.73 17.89 Favored 'General case' 0 N--CA 1.514 2.747 0 O-C-N 121.273 -0.892 . . . . 0.0 110.704 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 104.3 9.67 35.71 Favored Glycine 0 N--CA 1.496 2.649 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.843 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.661 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.6 p -113.78 135.03 54.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.783 1.792 . . . . 0.0 110.436 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.448 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.3 p -78.36 133.77 37.53 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.193 -0.942 . . . . 0.0 109.903 179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.3 ptt-85 -132.24 140.33 48.62 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.157 -0.964 . . . . 0.0 110.18 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.822 HG23 HG12 ' A' ' 8' ' ' VAL . 9.9 mt -107.83 125.24 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.26 -0.9 . . . . 0.0 109.447 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.57 144.86 15.89 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.439 ' HB3' ' CE2' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -119.43 135.21 54.85 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.118 -1.225 . . . . 0.0 109.453 179.336 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.7 t -111.98 111.78 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.943 -1.098 . . . . 0.0 110.241 -179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.5 t -116.45 112.41 41.36 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.242 -0.912 . . . . 0.0 109.758 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.94 126.08 10.96 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 123.232 1.122 . . . . 0.0 110.503 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 . . . . . 0 N--CA 1.498 1.969 0 O-C-N 121.187 -0.946 . . . . 0.0 110.01 179.615 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.476 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -132.45 143.62 49.91 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.183 -1.187 . . . . 0.0 110.264 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.7 mmm -117.84 135.43 54.09 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.222 -0.923 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -116.77 143.87 45.14 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.258 -0.901 . . . . 0.0 109.713 179.563 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -132.09 137.75 47.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.088 -1.007 . . . . 0.0 110.459 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.419 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 25.8 m95 -94.05 117.19 29.76 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.087 -1.008 . . . . 0.0 110.82 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.523 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.92 172.38 10.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.032 -1.042 . . . . 0.0 109.689 177.679 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -88.96 -173.11 3.95 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.335 -0.853 . . . . 0.0 110.238 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.531 HG22 ' ND1' ' A' ' 93' ' ' HIS . 23.0 mm -86.13 -50.77 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.374 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -61.87 -38.47 88.39 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.097 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.1 m -61.78 -50.94 70.32 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.172 -0.955 . . . . 0.0 108.98 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.431 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -67.28 -45.42 76.67 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.465 -0.772 . . . . 0.0 109.655 179.796 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.67 -28.65 68.63 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 119.214 -0.995 . . . . 0.0 110.023 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.09 -42.43 76.18 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 120.896 -1.128 . . . . 0.0 108.894 178.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -74.97 -42.32 57.83 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.8 tp -62.39 -38.89 91.38 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.407 -0.808 . . . . 0.0 109.143 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -67.03 -32.73 74.14 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.183 -0.948 . . . . 0.0 110.131 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -102.42 16.37 26.47 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.046 -1.034 . . . . 0.0 111.699 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.812 0 O-C-N 120.668 -1.27 . . . . 0.0 110.131 179.727 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 120.808 0.337 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.1 mt 55.28 99.22 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.147 -0.971 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -110.2 134.6 52.06 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.264 -0.898 . . . . 0.0 109.685 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.47 -164.75 0.09 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.059 -1.026 . . . . 0.0 110.206 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.536 HD22 ' OG1' ' A' ' 91' ' ' THR . 25.9 tp -121.7 53.84 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.08 -1.012 . . . . 0.0 110.765 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.42 37.03 0.47 Allowed 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.175 -0.953 . . . . 0.0 110.755 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.47 ' O ' HD23 ' A' ' 76' ' ' LEU . 1.4 tm-20 -133.63 30.27 3.8 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.1 -1.0 . . . . 0.0 110.533 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.758 HD22 ' HB3' ' A' ' 6' ' ' PHE . 88.7 mt -134.08 154.68 51.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.015 -1.053 . . . . 0.0 109.722 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -86.2 104.01 15.35 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.194 -0.941 . . . . 0.0 110.502 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.407 ' HA3' HG23 ' A' ' 8' ' ' VAL . . . 148.2 -36.77 1.1 Allowed Glycine 0 N--CA 1.493 2.498 0 C-N-CA 119.766 -1.207 . . . . 0.0 110.893 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.459 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 17.3 p-90 -57.88 -35.23 70.7 Favored 'General case' 0 N--CA 1.509 2.511 0 CA-C-N 119.034 1.417 . . . . 0.0 110.838 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.459 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 1.9 tp10 -74.92 -29.38 60.95 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.021 -1.05 . . . . 0.0 110.862 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -99.01 -25.59 14.51 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.917 -1.114 . . . . 0.0 112.004 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.558 HD13 ' CD2' ' A' ' 10' ' ' TYR . 64.2 mt -76.21 -175.57 3.22 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.679 -1.263 . . . . 0.0 110.273 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -63.31 152.74 37.04 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.188 -0.945 . . . . 0.0 110.345 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -88.26 -40.18 13.85 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.189 -0.944 . . . . 0.0 110.22 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -60.17 -51.51 69.26 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.218 -0.926 . . . . 0.0 109.842 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.449 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 42.8 mt-10 -61.49 -40.0 92.99 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.254 -0.903 . . . . 0.0 109.326 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.666 ' HA ' HD12 ' A' ' 90' ' ' ILE . 1.2 tmmt? -59.56 -41.07 89.32 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.328 -0.857 . . . . 0.0 109.535 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -54.54 -33.6 60.37 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.209 -0.932 . . . . 0.0 110.364 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -57.63 -37.62 73.61 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.994 -1.066 . . . . 0.0 110.206 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.666 HD12 ' HA ' ' A' ' 87' ' ' LYS . 7.2 mt -62.36 -36.79 76.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.119 -0.988 . . . . 0.0 109.511 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.536 ' OG1' HD22 ' A' ' 73' ' ' LEU . 28.0 m -58.15 -38.13 76.01 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.899 -1.125 . . . . 0.0 109.6 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -57.79 -38.11 74.9 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.302 -0.874 . . . . 0.0 109.765 179.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.531 ' ND1' HG22 ' A' ' 53' ' ' ILE . 5.7 m-70 -58.56 -53.5 57.58 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -61.92 -38.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.396 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.95 92.67 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.176 -0.952 . . . . 0.0 109.774 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -60.94 -39.33 89.07 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.157 -0.964 . . . . 0.0 109.798 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.02 -34.58 68.94 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 110.349 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.5 t -101.07 62.84 0.98 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.025 -1.047 . . . . 0.0 110.197 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.1 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.144 -0.972 . . . . 0.0 110.223 -179.973 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.1 mtp85 -120.06 145.66 46.65 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.185 -0.947 . . . . 0.0 110.273 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.522 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.4 m-85 -125.37 142.38 51.53 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.301 -0.874 . . . . 0.0 110.133 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.3 t -125.66 157.51 37.09 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.239 -0.913 . . . . 0.0 109.938 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.405 HG12 ' CD1' ' A' ' 82' ' ' LEU . 52.0 t -113.31 116.72 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.121 -0.987 . . . . 0.0 110.03 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.442 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 3.9 t70 -123.72 148.44 46.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.143 -0.973 . . . . 0.0 110.113 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.719 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -105.3 142.48 34.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.273 -0.892 . . . . 0.0 109.646 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.66 126.94 29.72 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.123 -0.986 . . . . 0.0 110.355 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -137.85 109.28 6.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.299 -0.876 . . . . 0.0 110.143 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 37.69 41.56 0.32 Allowed 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.62 164.77 26.62 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.3 m -144.4 122.43 12.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.124 -1.221 . . . . 0.0 110.347 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -153.21 139.44 18.43 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.185 -0.947 . . . . 0.0 111.133 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.99 129.13 49.1 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.906 -1.677 . . . . 0.0 108.906 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 32.0 p -66.79 119.84 12.51 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.156 -1.202 . . . . 0.0 111.118 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 12.6 mmtp -68.25 159.41 31.3 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.271 -0.893 . . . . 0.0 109.192 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 tptt 63.59 19.38 11.68 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.524 -1.36 . . . . 0.0 110.757 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.5 p -177.47 153.42 0.91 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 120.575 -1.328 . . . . 0.0 110.716 178.195 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -91.83 86.71 5.99 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.011 -1.055 . . . . 0.0 111.65 -178.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -165.51 -172.52 2.46 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.278 -0.889 . . . . 0.0 110.516 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.9 ttpt -127.65 155.9 43.18 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.139 -0.976 . . . . 0.0 109.978 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.572 HD11 ' O ' ' A' ' 50' ' ' TRP . 70.5 mt -107.25 124.96 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.041 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 29' ' ' VAL . 34.1 m -130.29 156.13 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.233 -0.917 . . . . 0.0 110.144 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ttpt -48.96 129.22 17.14 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.336 -0.853 . . . . 0.0 110.855 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 116.83 -8.26 16.84 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.573 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.658 HG12 ' O ' ' A' ' 26' ' ' VAL . 7.3 p -125.09 134.85 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-N 119.795 1.797 . . . . 0.0 110.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 30.7 p -76.86 142.74 40.08 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.071 -1.018 . . . . 0.0 110.245 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.473 ' HD3' HG21 ' A' ' 25' ' ' ILE . 5.6 ptt180 -136.42 146.33 46.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.16 -0.962 . . . . 0.0 110.381 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.436 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 30.6 mt -113.81 132.69 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.287 -0.883 . . . . 0.0 109.902 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' O ' ' A' ' 49' ' ' GLU . . . -108.8 155.5 16.08 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.0 ttpm? -118.26 130.74 56.23 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.187 -1.184 . . . . 0.0 109.781 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.497 HG22 ' HB3' ' A' ' 48' ' ' LYS . 61.7 t -104.24 107.96 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.121 -0.987 . . . . 0.0 109.983 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.427 HG23 ' HD2' ' A' ' 37' ' ' PRO . 10.3 p -123.97 143.33 42.0 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.221 -0.925 . . . . 0.0 110.027 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.427 ' HD2' HG23 ' A' ' 36' ' ' VAL . 45.9 Cg_endo -72.12 146.91 47.42 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.228 1.12 . . . . 0.0 110.331 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 . . . . . 0 N--CA 1.5 2.071 0 O-C-N 121.288 -0.883 . . . . 0.0 110.241 179.863 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.475 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -117.0 131.63 56.91 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.221 -1.164 . . . . 0.0 110.127 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 tpt -117.31 151.66 36.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.096 -1.002 . . . . 0.0 110.423 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.497 ' HB3' HG22 ' A' ' 35' ' ' VAL . 18.8 pttt -131.3 141.93 50.03 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.271 -0.893 . . . . 0.0 110.163 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.424 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 80.3 mt-10 -120.08 164.58 15.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.0 109.757 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.572 ' O ' HD11 ' A' ' 25' ' ' ILE . 18.3 m95 -113.9 128.25 56.32 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.065 -1.022 . . . . 0.0 110.735 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.522 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 7.0 p90 -151.94 173.42 14.85 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.492 177.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -80.91 176.71 9.58 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.579 -0.701 . . . . 0.0 112.555 -176.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.493 HG23 ' CE2' ' A' ' 57' ' ' PHE . 21.1 mt -88.73 -53.95 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -54.72 -36.53 64.84 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.053 -1.029 . . . . 0.0 109.583 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 7.2 m -63.02 -51.68 65.86 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.313 -0.867 . . . . 0.0 109.15 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.539 ' O ' HD13 ' A' ' 60' ' ' LEU . 7.5 tpt -69.03 -42.35 76.49 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.736 -0.786 . . . . 0.0 109.459 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.493 ' CE2' HG23 ' A' ' 53' ' ' ILE . 12.8 m-85 -67.46 -30.57 70.32 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.981 179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.94 -40.79 62.82 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.859 -1.15 . . . . 0.0 109.059 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -58.66 -39.31 80.26 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.369 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 56' ' ' MET . 6.7 mp -53.59 -41.87 67.05 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.158 -0.964 . . . . 0.0 109.263 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.5 -36.08 75.37 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.257 -0.902 . . . . 0.0 109.5 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.18 33.2 4.41 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.229 -0.92 . . . . 0.0 110.345 179.276 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.093 0 O-C-N 120.981 -1.075 . . . . 0.0 110.499 -179.879 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.435 ' HB2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 120.899 0.381 . . . . 0.0 110.816 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.7 mt -89.52 124.0 42.01 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.255 -0.903 . . . . 0.0 109.877 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -116.36 148.25 40.8 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.263 -0.898 . . . . 0.0 110.188 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.14 177.34 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.079 -1.013 . . . . 0.0 110.683 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.752 HD13 ' CG2' ' A' ' 90' ' ' ILE . 61.5 tp -127.85 87.81 2.67 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.207 -0.933 . . . . 0.0 110.368 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.613 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -172.38 -51.35 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.199 -0.938 . . . . 0.0 110.84 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.87 -35.65 33.86 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 121.027 -1.046 . . . . 0.0 110.603 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.15 150.89 44.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.131 -0.981 . . . . 0.0 109.659 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -101.96 123.51 45.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.18 -0.95 . . . . 0.0 110.174 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 135.78 -36.86 1.97 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.47 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 43.0 p-90 -56.37 -37.37 69.97 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.939 -1.33 . . . . 0.0 110.685 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.47 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 2.9 tm-20 -71.87 -37.41 70.21 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.7 -29.14 69.07 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.184 -0.947 . . . . 0.0 111.037 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.719 HD13 ' CD2' ' A' ' 10' ' ' TYR . 85.0 mt -81.39 -173.77 4.55 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.851 -1.155 . . . . 0.0 110.262 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.54 162.36 12.96 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.204 -0.935 . . . . 0.0 110.469 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -86.6 -41.1 14.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.273 -0.892 . . . . 0.0 110.137 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -60.83 -47.62 85.53 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.267 -0.895 . . . . 0.0 109.435 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.431 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 17.6 mt-10 -60.61 -39.05 86.76 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.356 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.61 ' HG2' HD21 ' A' ' 73' ' ' LEU . 6.1 ttpt -56.17 -40.09 73.35 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.788 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.93 -36.07 69.79 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.218 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.58 -36.14 75.65 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.002 -1.061 . . . . 0.0 110.424 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.752 ' CG2' HD13 ' A' ' 73' ' ' LEU . 53.4 mt -65.26 -40.08 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.03 -1.044 . . . . 0.0 109.565 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -44.37 96.26 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.026 -1.046 . . . . 0.0 109.081 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -64.82 -39.63 93.89 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.489 ' NE2' HG22 ' A' ' 53' ' ' ILE . 16.8 t60 -57.08 -48.0 79.65 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.23 -0.919 . . . . 0.0 109.742 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.429 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 11.6 mt -65.09 -38.49 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.281 -0.967 . . . . 0.0 109.132 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.12 84.79 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.189 -0.944 . . . . 0.0 109.666 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.05 -37.38 82.42 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.236 -0.915 . . . . 0.0 110.002 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.476 HD22 ' HD1' ' A' ' 57' ' ' PHE . 19.6 tp -81.42 -38.27 26.76 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.061 -1.024 . . . . 0.0 110.112 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 30.4 t -74.61 -38.25 62.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.496 1.87 0 O-C-N 121.136 -0.977 . . . . 0.0 110.03 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 . . . . . 0 N--CA 1.494 1.764 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.55 139.51 52.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.16 -0.962 . . . . 0.0 110.143 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.505 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.9 m-85 -119.74 154.66 33.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.182 -0.948 . . . . 0.0 110.326 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -143.76 134.29 24.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.318 -0.864 . . . . 0.0 110.298 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.783 HG23 HD23 ' A' ' 76' ' ' LEU . 47.7 t -102.5 105.76 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.223 -0.923 . . . . 0.0 109.671 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -118.02 159.45 23.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.14 -0.975 . . . . 0.0 110.874 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.73 149.1 27.65 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.545 -0.722 . . . . 0.0 109.637 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.43 123.74 27.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.173 -0.954 . . . . 0.0 109.953 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -149.65 39.36 0.79 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.183 -0.948 . . . . 0.0 110.588 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -136.38 -66.03 0.55 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.215 -0.928 . . . . 0.0 110.156 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.69 -137.67 2.52 Favored Glycine 0 N--CA 1.497 2.745 0 N-CA-C 110.064 -1.215 . . . . 0.0 110.064 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.946 HG22 HG12 ' A' ' 26' ' ' VAL . 70.3 p -122.78 116.22 23.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.231 -1.158 . . . . 0.0 110.038 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 134.67 54.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.131 -0.981 . . . . 0.0 110.653 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.27 123.12 31.55 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 108.527 -1.829 . . . . 0.0 108.527 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.737 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 26.3 p -64.59 129.09 38.5 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.29 -1.123 . . . . 0.0 110.914 -178.287 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 35.5 mmtt -75.45 156.02 35.7 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.578 -0.701 . . . . 0.0 109.251 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 65.76 15.82 10.22 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.85 -1.156 . . . . 0.0 111.704 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.737 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.8 p -174.91 151.27 1.35 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.557 -1.339 . . . . 0.0 110.752 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -87.1 90.73 8.46 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.053 -1.029 . . . . 0.0 111.647 -177.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.409 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 0.4 OUTLIER -167.62 -174.0 2.35 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.332 -0.855 . . . . 0.0 110.412 178.947 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -126.08 154.03 43.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.989 -1.07 . . . . 0.0 110.036 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.556 HD13 ' HD3' ' A' ' 31' ' ' ARG . 80.4 mt -109.86 103.09 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.404 -0.81 . . . . 0.0 109.912 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.946 HG12 HG22 ' A' ' 15' ' ' THR . 22.9 m -110.98 162.98 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.259 -0.901 . . . . 0.0 110.397 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -49.6 137.27 15.73 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.415 -0.803 . . . . 0.0 111.033 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.36 50.74 Favored Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.184 -1.007 . . . . 0.0 111.499 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.1 p -126.86 137.36 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.73 1.765 . . . . 0.0 110.786 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.495 ' SG ' HD21 ' A' ' 82' ' ' LEU . 42.3 t -93.49 138.98 31.25 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.237 -0.914 . . . . 0.0 109.774 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.1 ptt180 -135.09 147.78 49.64 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.258 -0.901 . . . . 0.0 110.348 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.436 HG22 ' HD1' ' A' ' 6' ' ' PHE . 15.1 mt -106.33 123.83 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.313 -0.867 . . . . 0.0 109.523 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.24 137.22 13.32 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.458 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 37.4 ttpt -107.26 124.2 49.42 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.233 -1.157 . . . . 0.0 109.379 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.4 t -99.98 114.45 38.48 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.069 -1.019 . . . . 0.0 110.321 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.2 p -121.82 138.18 28.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.292 -0.88 . . . . 0.0 110.345 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.2 151.28 34.1 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 O-C-N 123.003 1.002 . . . . 0.0 110.458 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 . . . . . 0 N--CA 1.5 2.025 0 O-C-N 121.298 -0.876 . . . . 0.0 110.088 179.748 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.528 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.76 143.83 44.44 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.255 -1.144 . . . . 0.0 109.986 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 mmt -116.82 139.08 51.02 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.172 -0.955 . . . . 0.0 110.285 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 6.1 ttmm -129.37 130.64 46.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.276 -0.89 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -114.68 138.74 50.34 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.204 -0.935 . . . . 0.0 109.82 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 11.5 m95 -93.98 112.76 24.63 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.191 -0.943 . . . . 0.0 110.852 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.505 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 0.7 OUTLIER -123.54 170.93 9.92 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.47 177.064 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -88.97 -173.88 4.25 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.442 -0.786 . . . . 0.0 110.338 -179.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.558 HG22 ' CE1' ' A' ' 93' ' ' HIS . 34.7 mm -83.22 -54.61 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.49 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 tttp -60.07 -37.5 80.05 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.292 -0.88 . . . . 0.0 109.398 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.4 m -60.75 -51.22 70.28 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.208 -0.932 . . . . 0.0 109.14 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 11.3 tpt -69.21 -45.43 69.87 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.365 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 11.2 m-85 -63.21 -29.88 71.13 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.833 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -62.84 -41.55 99.39 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.885 -1.134 . . . . 0.0 109.122 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -40.88 92.11 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.226 -0.921 . . . . 0.0 108.927 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -55.78 -41.71 74.49 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.139 -0.976 . . . . 0.0 109.237 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.26 -35.45 71.76 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.314 -0.866 . . . . 0.0 109.581 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.7 mmt85 -105.97 31.16 5.27 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.196 -0.94 . . . . 0.0 110.544 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.853 0 O-C-N 120.987 -1.071 . . . . 0.0 110.086 179.939 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.776 0.322 . . . . 0.0 110.284 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.3 mt 54.21 99.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.08 -1.013 . . . . 0.0 110.782 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -107.43 139.18 42.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.188 -0.945 . . . . 0.0 109.403 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.62 -163.99 0.12 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.964 -1.085 . . . . 0.0 110.053 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.648 HD21 ' HG3' ' A' ' 87' ' ' LYS . 56.4 tp -116.08 70.84 0.76 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.034 -1.041 . . . . 0.0 110.473 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.68 -163.7 0.34 Allowed 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.229 -0.92 . . . . 0.0 110.314 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 54.44 37.45 27.76 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.996 -1.065 . . . . 0.0 110.259 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.783 HD23 HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -145.22 151.53 38.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.197 -0.94 . . . . 0.0 109.74 -179.774 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -94.49 97.18 9.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.123 -0.985 . . . . 0.0 109.99 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.12 -36.56 0.95 Allowed Glycine 0 N--CA 1.495 2.627 0 C-N-CA 119.72 -1.229 . . . . 0.0 110.752 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 52.8 p-90 -56.01 -34.78 66.14 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.921 1.36 . . . . 0.0 110.616 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.41 -43.81 96.42 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.052 -1.03 . . . . 0.0 109.439 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -60.45 -39.75 88.68 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.14 -0.975 . . . . 0.0 109.75 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.551 ' CD2' HD11 ' A' ' 90' ' ' ILE . 3.5 mp -49.38 173.56 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.907 0 O-C-N 121.219 -0.926 . . . . 0.0 110.643 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -101.23 161.0 13.93 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.069 -1.019 . . . . 0.0 110.383 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -55.59 -36.18 66.61 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.181 -0.949 . . . . 0.0 110.967 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -70.41 -43.48 69.9 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.063 -1.023 . . . . 0.0 109.452 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.41 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 22.2 mt-10 -70.64 -39.35 73.71 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.839 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.648 ' HG3' HD21 ' A' ' 73' ' ' LEU . 26.0 tttt -61.81 -37.43 84.38 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.286 -0.884 . . . . 0.0 109.853 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -65.91 -40.25 91.32 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.149 -0.969 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.33 79.72 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.241 -0.912 . . . . 0.0 110.538 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.6 HG22 HD13 ' A' ' 73' ' ' LEU . 98.5 mt -68.19 -36.99 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 O-C-N 121.113 -0.992 . . . . 0.0 109.434 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.43 -38.92 88.89 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.886 -1.134 . . . . 0.0 109.451 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -57.39 -37.96 73.51 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.164 -0.96 . . . . 0.0 109.874 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.558 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.7 m-70 -55.01 -47.8 74.2 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.116 -0.99 . . . . 0.0 110.066 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mp -66.0 -38.89 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.238 -0.914 . . . . 0.0 109.197 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.26 79.21 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.186 -0.946 . . . . 0.0 109.696 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.8 -36.97 85.01 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.168 -0.958 . . . . 0.0 109.903 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.2 tp -82.31 -30.9 30.24 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.066 -1.021 . . . . 0.0 110.646 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.8 t -101.26 55.78 0.84 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.869 -1.145 . . . . 0.0 110.263 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 p . . . . . 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.015 . . . . 0.0 110.247 179.779 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.76 126.18 51.98 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.233 -0.917 . . . . 0.0 110.177 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.822 ' HB3' HD11 ' A' ' 76' ' ' LEU . 1.5 m-85 -116.18 143.95 44.82 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.171 -0.956 . . . . 0.0 110.059 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.5 p -141.03 138.32 33.58 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.237 -0.914 . . . . 0.0 109.877 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.76 HG13 ' CD2' ' A' ' 76' ' ' LEU . 21.7 m -104.53 140.5 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.093 -1.004 . . . . 0.0 110.222 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -142.28 156.05 45.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.245 -0.909 . . . . 0.0 110.335 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -107.35 154.07 21.83 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.359 -0.838 . . . . 0.0 109.792 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.532 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . . . -82.33 142.27 32.18 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.243 -0.911 . . . . 0.0 110.058 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -143.51 -59.86 0.41 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.292 -0.88 . . . . 0.0 110.163 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.62 84.57 2.25 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.251 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.34 174.82 14.51 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.543 HG22 HG12 ' A' ' 26' ' ' VAL . 55.3 p -140.68 139.18 34.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.184 -1.186 . . . . 0.0 110.204 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -123.42 150.77 43.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.214 -0.929 . . . . 0.0 110.677 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.08 120.13 5.22 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.6 t -64.71 122.52 17.07 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.262 -1.14 . . . . 0.0 109.732 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.83 148.05 44.52 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.057 -1.027 . . . . 0.0 108.669 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp 53.0 64.93 1.67 Allowed 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.906 -1.121 . . . . 0.0 108.949 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -172.94 -43.65 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.221 -0.924 . . . . 0.0 112.555 -177.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tttm 70.06 44.85 0.75 Allowed 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.884 -1.135 . . . . 0.0 108.202 -177.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.72 -168.38 2.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.556 -0.715 . . . . 0.0 109.49 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -137.22 157.5 46.52 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.984 -1.073 . . . . 0.0 110.42 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.591 HG23 HG13 ' A' ' 29' ' ' VAL . 69.5 mt -110.95 110.28 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.402 -0.811 . . . . 0.0 109.826 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.798 ' O ' HG12 ' A' ' 29' ' ' VAL . 24.4 m -110.11 169.39 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 O-C-N 121.187 -0.946 . . . . 0.0 110.614 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HA ' ' HB3' ' A' ' 11' ' ' ALA . 35.8 tttt -46.6 138.61 5.8 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 121.56 -0.712 . . . . 0.0 111.136 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 107.57 -23.16 27.02 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.968 -1.11 . . . . 0.0 110.533 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.798 HG12 ' O ' ' A' ' 26' ' ' VAL . 14.8 p -113.52 137.59 46.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-N 119.151 1.475 . . . . 0.0 110.318 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.655 ' HB3' HD11 ' A' ' 53' ' ' ILE . 44.8 t -91.17 142.43 27.75 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.045 -1.035 . . . . 0.0 110.199 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.449 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 1.1 ptt180 -128.16 153.3 47.03 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.143 -0.973 . . . . 0.0 110.533 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.413 HD12 ' HG2' ' A' ' 56' ' ' MET . 11.4 mt -111.95 137.26 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.344 -0.847 . . . . 0.0 110.414 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.414 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.09 129.2 9.58 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 108.348 -1.901 . . . . 0.0 108.348 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.45 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 33.6 ttpt -110.15 116.96 32.47 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.069 -1.253 . . . . 0.0 110.395 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.6 t -109.24 109.4 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.222 -0.924 . . . . 0.0 110.017 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.3 t -120.53 112.57 34.03 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.215 -0.928 . . . . 0.0 109.961 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.3 133.75 19.82 Favored 'Trans proline' 0 C--N 1.32 -0.941 0 O-C-N 123.119 1.063 . . . . 0.0 110.393 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 61.1 t30 . . . . . 0 N--CA 1.5 2.049 0 O-C-N 121.203 -0.935 . . . . 0.0 110.028 179.719 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.48 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -133.33 147.41 51.84 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.167 -1.196 . . . . 0.0 110.331 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.7 mtt -115.27 143.58 45.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.167 -0.958 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -118.6 123.88 46.08 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.225 -0.922 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -116.66 137.21 52.36 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.181 -0.949 . . . . 0.0 109.897 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 26.7 m95 -92.84 134.48 35.04 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.219 -0.925 . . . . 0.0 109.998 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -121.71 176.01 5.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.255 -0.903 . . . . 0.0 110.739 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.4 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 2.6 m80 -96.69 -172.36 2.47 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.876 HG22 ' CE1' ' A' ' 93' ' ' HIS . 39.8 mm -84.74 -37.14 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.998 -1.064 . . . . 0.0 109.275 178.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.45 -27.26 20.49 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.74 -1.225 . . . . 0.0 111.213 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 83.3 m -70.46 -46.49 63.7 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.819 -1.176 . . . . 0.0 110.435 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.413 ' HG2' HD12 ' A' ' 32' ' ' ILE . 9.7 tpt -68.8 -38.52 80.0 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.323 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.455 ' CE1' HG13 ' A' ' 94' ' ' ILE . 9.3 m-85 -75.05 -31.43 61.3 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.803 -1.159 . . . . 0.0 109.578 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -62.51 -36.21 81.82 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.026 -1.047 . . . . 0.0 109.524 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -60.24 -40.16 89.28 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.093 -1.005 . . . . 0.0 109.758 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.781 ' HB3' HD21 ' A' ' 97' ' ' LEU . 10.1 mp -60.96 -42.33 98.08 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.975 . . . . 0.0 109.154 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.4 ' N ' HD11 ' A' ' 97' ' ' LEU . 6.9 tt0 -56.08 -33.68 65.27 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.205 -0.935 . . . . 0.0 109.674 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 33.4 mtm-85 -102.63 29.59 5.21 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.279 -0.888 . . . . 0.0 110.449 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.808 0 O-C-N 120.905 -1.122 . . . . 0.0 109.902 179.742 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.402 ' O ' HD21 ' A' ' 60' ' ' LEU . 13.3 mtmt . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 120.699 0.285 . . . . 0.0 110.402 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.2 mt 54.77 101.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.2 -0.937 . . . . 0.0 110.821 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -110.92 143.32 41.73 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.068 -1.02 . . . . 0.0 109.892 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.58 -170.75 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.039 -1.038 . . . . 0.0 110.477 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.709 HD21 ' CG ' ' A' ' 87' ' ' LYS . 2.8 tp -111.37 43.4 1.5 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.146 -0.971 . . . . 0.0 110.105 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.9 -168.9 3.24 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.141 -0.974 . . . . 0.0 110.051 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 55.42 38.11 29.83 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.905 -1.122 . . . . 0.0 109.935 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.822 HD11 ' HB3' ' A' ' 6' ' ' PHE . 1.5 tp -144.65 150.44 37.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.348 -0.845 . . . . 0.0 109.48 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -93.78 104.45 16.53 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.061 -1.024 . . . . 0.0 110.464 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.412 ' HA3' HG22 ' A' ' 8' ' ' VAL . . . 150.02 -45.26 0.68 Allowed Glycine 0 N--CA 1.494 2.514 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.762 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 34.0 p-90 -58.72 -35.51 72.79 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.004 -1.292 . . . . 0.0 110.614 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -56.17 -34.4 66.14 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.921 -1.112 . . . . 0.0 110.699 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -83.58 -34.87 25.08 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.953 -1.092 . . . . 0.0 110.722 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.651 ' CD2' HD11 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -49.77 175.1 0.01 OUTLIER 'General case' 0 N--CA 1.518 2.93 0 O-C-N 121.067 -1.02 . . . . 0.0 110.941 -179.682 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.76 161.61 13.53 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.312 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.59 -45.3 89.41 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.976 . . . . 0.0 110.41 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -61.52 -51.75 67.32 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.533 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.65 -39.33 94.09 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.111 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.763 ' HA ' HD12 ' A' ' 90' ' ' ILE . 19.9 ttpp -59.96 -38.75 83.39 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.305 -0.872 . . . . 0.0 109.709 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -60.32 -39.35 86.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.15 -0.969 . . . . 0.0 109.861 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.84 -40.95 90.25 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.14 -0.975 . . . . 0.0 110.1 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 87' ' ' LYS . 10.4 mt -62.28 -40.19 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 O-C-N 121.205 -0.934 . . . . 0.0 109.524 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.9 m -58.15 -39.62 79.25 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.04 -1.037 . . . . 0.0 109.921 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.8 -39.27 80.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.227 -0.92 . . . . 0.0 109.627 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.876 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.3 m-70 -60.01 -52.04 67.08 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.253 -0.904 . . . . 0.0 109.778 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.455 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.6 mt -62.68 -39.08 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.383 -0.927 . . . . 0.0 109.444 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.72 94.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.187 -0.946 . . . . 0.0 109.47 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.7 -39.7 66.78 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.229 -0.919 . . . . 0.0 109.11 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.781 HD21 ' HB3' ' A' ' 60' ' ' LEU . 21.6 tp -68.5 -32.58 72.66 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.267 -0.896 . . . . 0.0 110.363 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 16.3 t -92.81 -40.63 10.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.925 -1.109 . . . . 0.0 110.177 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.143 -0.973 . . . . 0.0 110.147 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.184 0 CA-C-O 120.948 0.404 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -124.01 129.98 51.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.147 -0.971 . . . . 0.0 110.167 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.4 m-85 -124.02 137.44 54.59 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.158 -0.964 . . . . 0.0 110.086 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.2 t -126.77 147.87 49.96 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 109.628 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.888 ' CG1' HD23 ' A' ' 76' ' ' LEU . 27.2 m -116.18 139.63 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 121.057 -1.027 . . . . 0.0 110.604 179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -147.5 162.73 38.47 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.24 -0.913 . . . . 0.0 110.399 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.706 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.6 OUTLIER -110.29 141.55 43.12 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.368 -0.832 . . . . 0.0 109.814 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.439 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -63.93 134.06 54.4 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.744 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -140.62 -65.68 0.45 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.209 -0.932 . . . . 0.0 110.465 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -121.97 85.33 2.39 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.176 -0.953 . . . . 0.0 110.228 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 126.92 159.36 10.16 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -132.48 149.64 52.3 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.212 -1.169 . . . . 0.0 110.086 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.06 145.85 50.58 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.168 -0.958 . . . . 0.0 110.557 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.43 118.63 7.97 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.9 t -63.85 123.28 18.52 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.191 -1.182 . . . . 0.0 109.695 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HB2' ' CE2' ' A' ' 51' ' ' TYR . 0.8 OUTLIER -61.61 147.86 44.33 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.08 -1.013 . . . . 0.0 108.664 179.176 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt 53.09 64.66 1.78 Allowed 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.979 -1.076 . . . . 0.0 108.815 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -173.04 -43.58 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.249 -0.907 . . . . 0.0 112.583 -177.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt 69.06 44.15 1.04 Allowed 'General case' 0 N--CA 1.505 2.295 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -177.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 -168.71 2.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.564 -0.71 . . . . 0.0 109.437 -179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -140.1 158.67 43.69 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.017 -1.052 . . . . 0.0 110.193 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.644 HG23 ' CG2' ' A' ' 29' ' ' VAL . 50.8 mt -102.89 118.12 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.505 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.3 t -107.76 160.25 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.162 -0.961 . . . . 0.0 110.352 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -48.49 121.7 4.74 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 121.444 -0.785 . . . . 0.0 111.15 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.68 -25.93 5.24 Favored Glycine 0 N--CA 1.493 2.448 0 C-N-CA 119.999 -1.096 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.644 ' CG2' HG23 ' A' ' 25' ' ' ILE . 6.6 m -104.38 137.61 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 CA-C-N 119.148 1.474 . . . . 0.0 110.488 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.919 ' HB3' HD11 ' A' ' 53' ' ' ILE . 1.3 t -81.06 134.99 35.76 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.192 -0.942 . . . . 0.0 109.647 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.432 ' CB ' HD13 ' A' ' 25' ' ' ILE . 12.0 ptt-85 -122.43 149.03 44.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.201 -0.937 . . . . 0.0 110.402 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.1 mt -108.35 139.87 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.315 -0.865 . . . . 0.0 110.603 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.03 122.38 6.9 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 41.0 tttt -105.97 120.07 40.83 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.101 -1.235 . . . . 0.0 110.082 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.429 HG12 ' CB ' ' A' ' 46' ' ' ASP . 62.1 t -103.5 107.17 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.25 -0.906 . . . . 0.0 110.22 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.7 t -122.31 138.31 28.89 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 109.615 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.92 131.89 16.24 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.262 1.138 . . . . 0.0 110.22 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 . . . . . 0 N--CA 1.499 1.999 0 O-C-N 121.102 -0.999 . . . . 0.0 110.166 179.883 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.429 ' CB ' HG12 ' A' ' 35' ' ' VAL . 0.9 OUTLIER -116.74 158.09 24.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.166 -1.196 . . . . 0.0 110.245 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttt -101.72 144.16 30.76 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.363 -0.836 . . . . 0.0 110.119 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HE3' ' CZ2' ' A' ' 50' ' ' TRP . 26.9 ttpt -116.53 123.01 46.37 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.327 -0.858 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -115.26 140.36 49.17 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.346 -0.846 . . . . 0.0 109.712 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.452 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 57.0 m95 -97.83 128.14 44.26 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.137 -0.977 . . . . 0.0 110.167 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 19' ' ' LYS . 97.4 m-85 -115.81 174.64 5.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.344 -0.847 . . . . 0.0 110.855 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.8 m80 -91.28 -171.43 2.95 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.98 HG22 ' CE1' ' A' ' 93' ' ' HIS . 46.6 mm -83.49 -39.9 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.879 -1.138 . . . . 0.0 109.722 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -85.06 -32.26 22.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 120.83 -1.169 . . . . 0.0 111.058 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 71.2 m -62.68 -52.89 61.51 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.994 -1.066 . . . . 0.0 110.4 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -40.39 88.02 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.012 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.673 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 9.6 m-85 -70.97 -30.43 66.7 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 119.08 -1.048 . . . . 0.0 109.634 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -61.35 -36.86 81.35 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.598 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.14 88.58 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.024 -1.048 . . . . 0.0 109.804 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 69' ' ' LYS . 10.2 mp -63.05 -44.42 95.92 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.429 -0.909 . . . . 0.0 108.969 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.38 -33.62 68.01 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.218 -0.926 . . . . 0.0 109.695 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.65 29.33 5.82 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.277 -0.889 . . . . 0.0 110.576 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.753 0 O-C-N 120.888 -1.133 . . . . 0.0 110.042 179.841 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.536 ' O ' HD21 ' A' ' 60' ' ' LEU . 17.2 mtpp . . . . . 0 N--CA 1.494 1.771 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.4 mt 54.54 99.34 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.213 -0.929 . . . . 0.0 110.704 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -112.7 135.25 53.66 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 0.0 109.978 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.0 -173.52 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.039 -1.038 . . . . 0.0 110.547 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.697 ' O ' HG23 ' A' ' 74' ' ' THR . 49.8 tp -113.71 83.26 1.82 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.162 -0.961 . . . . 0.0 110.22 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -170.0 -51.62 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.161 -0.962 . . . . 0.0 111.056 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -49.38 -36.32 21.43 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.113 -0.992 . . . . 0.0 110.796 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.888 HD23 ' CG1' ' A' ' 8' ' ' VAL . 6.3 mp -72.74 150.43 42.87 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.189 -0.944 . . . . 0.0 109.367 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.524 ' O ' HG22 ' A' ' 8' ' ' VAL . 12.9 mm-40 -97.77 136.74 37.68 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.249 -0.907 . . . . 0.0 111.251 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.53 -41.63 1.52 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.46 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 52.9 p-90 -53.96 -35.65 62.01 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.993 -1.298 . . . . 0.0 110.868 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.46 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 15.8 tt0 -68.11 -28.93 67.76 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.111 -0.993 . . . . 0.0 111.035 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -96.38 -34.52 11.51 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 120.826 -1.171 . . . . 0.0 111.251 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.706 HD13 ' CD2' ' A' ' 10' ' ' TYR . 74.4 mt -59.25 -175.3 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.865 -1.147 . . . . 0.0 110.151 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.33 161.63 11.21 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.154 -0.966 . . . . 0.0 110.26 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.2 -45.43 11.33 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.217 -0.927 . . . . 0.0 109.925 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -62.6 -42.45 99.58 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.315 -0.866 . . . . 0.0 109.396 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.422 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 1.1 mp0 -61.57 -40.28 94.16 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.338 -0.851 . . . . 0.0 109.514 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.521 ' CG ' HD21 ' A' ' 73' ' ' LEU . 22.2 ttpt -57.66 -39.57 77.33 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.322 -0.861 . . . . 0.0 109.943 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -60.41 -42.23 95.53 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.206 -0.933 . . . . 0.0 109.637 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -59.81 -35.37 74.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.324 -0.86 . . . . 0.0 110.237 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.568 ' CG2' HD13 ' A' ' 73' ' ' LEU . 37.9 mm -60.33 -38.93 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.492 0 O-C-N 121.109 -0.994 . . . . 0.0 109.634 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 m -58.59 -42.53 88.29 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.02 -1.05 . . . . 0.0 109.795 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -63.35 -40.64 97.84 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.297 -0.877 . . . . 0.0 109.284 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.98 ' CE1' HG22 ' A' ' 53' ' ' ILE . 67.6 t60 -58.39 -41.8 85.7 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.192 -0.942 . . . . 0.0 109.59 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.441 ' CG1' ' CZ ' ' A' ' 57' ' ' PHE . 9.3 mt -69.75 -39.62 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.176 -0.952 . . . . 0.0 108.9 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.89 -38.05 84.32 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.211 -0.931 . . . . 0.0 109.728 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -63.62 -41.48 98.27 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.134 -0.978 . . . . 0.0 109.488 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.446 HD21 ' HB3' ' A' ' 60' ' ' LEU . 5.9 tp -60.7 -35.58 76.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.243 -0.911 . . . . 0.0 110.33 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.1 t -89.93 -39.29 13.1 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.05 -1.031 . . . . 0.0 110.178 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.495 1.8 0 O-C-N 121.183 -0.948 . . . . 0.0 110.099 179.868 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -141.47 125.43 17.17 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.915 . . . . 0.0 110.288 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.443 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 0.9 OUTLIER -117.05 141.56 48.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.17 -0.956 . . . . 0.0 110.052 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' O ' HG23 ' A' ' 32' ' ' ILE . 80.5 m -127.74 156.39 42.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 109.803 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.415 HG23 ' HB3' ' A' ' 76' ' ' LEU . 59.6 t -111.2 120.58 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.128 -0.982 . . . . 0.0 109.927 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -137.95 156.45 47.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.136 -0.978 . . . . 0.0 110.605 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -101.45 154.1 19.11 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.485 -0.76 . . . . 0.0 109.693 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.27 140.76 29.38 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.246 -0.909 . . . . 0.0 110.34 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 tttp -136.03 -58.11 0.76 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.279 -0.888 . . . . 0.0 110.456 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -134.34 99.14 4.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.075 . . . . 0.0 110.316 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.6 138.65 3.35 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 26' ' ' VAL . 76.6 p -124.54 146.35 49.06 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.189 -1.183 . . . . 0.0 109.942 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -163.35 153.93 16.16 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.18 -0.95 . . . . 0.0 111.435 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.77 120.13 8.66 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.475 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 24.5 p -58.92 140.29 55.64 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.184 -1.186 . . . . 0.0 110.21 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 8.0 tptt -94.19 150.73 20.04 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.114 -0.991 . . . . 0.0 110.581 -178.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 13.2 mptt 51.6 48.39 22.97 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.475 ' HB3' ' SG ' ' A' ' 18' ' ' CYS 0.263 10.4 t -165.2 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.861 -0.524 . . . . 0.0 110.485 -175.481 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 21' ' ' CYS . 23.5 tttt 78.12 74.22 0.06 Allowed 'General case' 0 N--CA 1.526 3.342 0 O-C-N 120.947 -1.096 . . . . 0.0 112.492 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.4 tt0 -176.11 -172.88 0.53 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.165 -0.959 . . . . 0.0 110.604 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -120.3 146.16 46.38 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.112 -0.992 . . . . 0.0 109.142 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.9 mt -107.11 141.82 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.058 -1.026 . . . . 0.0 110.477 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.555 ' HA ' HG22 ' A' ' 15' ' ' THR . 59.4 t -141.12 158.04 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.249 -0.907 . . . . 0.0 109.961 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.54 135.97 17.43 Favored 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.287 -0.883 . . . . 0.0 111.089 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.56 8.72 39.81 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.155 -1.021 . . . . 0.0 111.828 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.8 p -127.45 132.79 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-N 119.853 1.827 . . . . 0.0 110.855 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 20.2 t -73.19 143.3 47.25 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.22 -0.925 . . . . 0.0 108.855 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.428 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 11.9 ptt180 -145.47 155.38 43.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.123 -0.986 . . . . 0.0 111.475 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.527 HG23 ' O ' ' A' ' 7' ' ' CYS . 3.8 mt -105.08 145.09 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.449 -0.782 . . . . 0.0 109.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.83 137.69 13.91 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 108.413 -1.875 . . . . 0.0 108.413 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.443 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 19.4 ttpt -117.94 123.75 46.55 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.903 -1.351 . . . . 0.0 110.42 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -96.44 113.09 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.229 -0.919 . . . . 0.0 110.115 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.9 t -120.49 119.13 30.6 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.267 -0.896 . . . . 0.0 109.916 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.35 145.66 38.73 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 O-C-N 123.132 1.07 . . . . 0.0 110.342 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.7 t30 . . . . . 0 N--CA 1.5 2.039 0 O-C-N 121.149 -0.97 . . . . 0.0 110.151 179.874 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.436 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -144.22 136.61 26.66 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -1.207 . . . . 0.0 110.268 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ttt -117.04 142.95 46.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.275 -0.891 . . . . 0.0 110.34 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -125.25 120.74 32.09 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.278 -0.889 . . . . 0.0 110.26 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -117.98 149.46 40.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.254 -0.904 . . . . 0.0 109.221 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.428 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 16.9 m95 -91.62 163.2 14.2 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.105 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.447 ' OH ' ' HB2' ' A' ' 20' ' ' LYS . 34.0 m-85 -140.39 173.91 11.04 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.38 -0.825 . . . . 0.0 110.841 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.439 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 11.1 m80 -108.77 -176.92 3.17 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.361 -0.837 . . . . 0.0 109.52 177.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 1.009 HG22 ' CE1' ' A' ' 93' ' ' HIS . 48.7 mm -97.48 -60.45 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -80.1 -43.14 22.25 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.782 -1.199 . . . . 0.0 109.388 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.439 ' HB3' ' CB ' ' A' ' 52' ' ' HIS . 19.3 t -63.12 -27.99 69.76 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.71 178.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -83.2 -54.34 5.09 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.725 -1.234 . . . . 0.0 108.648 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.576 ' HD2' HD22 ' A' ' 97' ' ' LEU . 13.0 m-85 -59.61 -26.55 65.56 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.72 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.71 -38.98 86.89 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.833 -1.167 . . . . 0.0 109.375 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.5 tttm -67.96 -40.65 83.17 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.281 178.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.75 -41.76 96.06 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.239 -0.913 . . . . 0.0 109.081 179.031 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' A' ' 97' ' ' LEU . 8.4 tt0 -56.17 -33.41 65.22 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.245 -0.909 . . . . 0.0 109.695 178.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.3 mtp-105 -103.68 29.87 5.46 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.316 -0.865 . . . . 0.0 110.573 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.84 0 O-C-N 120.948 -1.095 . . . . 0.0 110.026 179.852 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.7 mtpt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 110.183 -0.302 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.3 97.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.174 -0.953 . . . . 0.0 110.642 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -114.79 136.2 53.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.147 -0.97 . . . . 0.0 110.333 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.67 -178.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.043 -1.036 . . . . 0.0 110.919 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.787 HD13 ' CG2' ' A' ' 90' ' ' ILE . 62.3 tp -114.4 81.22 1.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.291 -0.881 . . . . 0.0 110.374 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.507 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -172.17 -51.63 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 110.722 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -51.19 -36.77 43.0 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.11 -0.994 . . . . 0.0 110.425 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' A' ' 6' ' ' PHE . 1.4 mp -63.46 152.33 38.68 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.136 -0.978 . . . . 0.0 109.451 179.36 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -102.1 116.29 32.36 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.187 -0.946 . . . . 0.0 110.307 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.08 -36.12 1.77 Allowed Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.909 -1.139 . . . . 0.0 110.467 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -51.53 -32.24 27.12 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.894 -1.357 . . . . 0.0 111.021 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -56.7 -39.87 74.63 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.907 -1.121 . . . . 0.0 110.126 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.61 -41.16 93.04 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.169 -0.957 . . . . 0.0 109.629 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.61 ' CD2' HD11 ' A' ' 90' ' ' ILE . 3.8 mp -47.67 165.55 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.913 0 O-C-N 121.291 -0.881 . . . . 0.0 110.875 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -88.47 161.37 17.05 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.226 -0.921 . . . . 0.0 109.823 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -56.32 -38.27 71.09 Favored 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.15 -0.968 . . . . 0.0 110.687 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -71.89 -40.42 68.91 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.182 -0.949 . . . . 0.0 109.707 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.4 -36.16 65.97 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.222 -0.924 . . . . 0.0 109.346 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.495 ' HG2' HD21 ' A' ' 73' ' ' LEU . 12.7 tttm -69.56 -37.67 77.12 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.117 -0.989 . . . . 0.0 109.625 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.55 -39.49 93.85 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.211 -0.931 . . . . 0.0 109.667 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -59.82 -34.03 72.53 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.787 ' CG2' HD13 ' A' ' 73' ' ' LEU . 96.5 mt -65.01 -39.92 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.02 -1.05 . . . . 0.0 109.571 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 73' ' ' LEU . 73.8 p -61.82 -46.76 88.09 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.063 -1.023 . . . . 0.0 109.354 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -61.66 -38.96 89.69 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.267 -0.896 . . . . 0.0 108.897 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 1.009 ' CE1' HG22 ' A' ' 53' ' ' ILE . 42.1 t60 -57.22 -48.82 77.83 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.238 -0.914 . . . . 0.0 109.737 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.0 mt -69.49 -39.97 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.648 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.73 -35.98 81.51 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.683 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.31 -37.6 85.78 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.576 HD22 ' HD2' ' A' ' 57' ' ' PHE . 4.3 tp -74.93 -40.52 60.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.114 -0.991 . . . . 0.0 110.032 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.0 t -60.99 -44.0 98.04 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.219 -0.926 . . . . 0.0 109.882 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.494 1.764 0 O-C-N 121.252 -0.905 . . . . 0.0 110.272 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 120.734 0.302 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 -136.73 149.67 47.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.153 -0.967 . . . . 0.0 110.143 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.874 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -120.55 149.82 41.83 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.268 -0.895 . . . . 0.0 110.472 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.0 t -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.251 -0.906 . . . . 0.0 109.666 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.767 HG12 HG23 ' A' ' 32' ' ' ILE . 20.0 m -102.79 106.21 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.143 -0.973 . . . . 0.0 110.671 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -118.26 158.95 24.21 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.917 -1.115 . . . . 0.0 110.476 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CD2' HD11 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -101.69 144.4 30.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.49 -0.756 . . . . 0.0 109.819 179.797 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.95 102.04 0.14 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.245 -0.91 . . . . 0.0 109.879 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -123.42 110.81 15.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 0.0 110.167 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 52.94 88.51 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.06 -1.025 . . . . 0.0 110.708 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.16 131.36 2.76 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 69.1 p -129.86 140.63 50.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -1.175 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -159.01 148.6 18.93 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.168 -0.957 . . . . 0.0 111.477 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.0 126.26 38.08 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.232 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 21.1 p -64.25 126.33 27.41 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.261 -1.14 . . . . 0.0 110.837 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 17.3 mttm -75.59 156.71 34.7 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.87 15.07 10.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.974 -1.079 . . . . 0.0 111.492 -178.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.2 p -175.51 151.44 1.21 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.555 -1.341 . . . . 0.0 110.602 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.63 90.48 8.27 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.989 -1.069 . . . . 0.0 111.731 -177.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.414 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 1.3 tt0 -168.88 -175.13 2.27 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.257 -0.902 . . . . 0.0 110.64 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.34 153.59 46.87 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.082 -1.011 . . . . 0.0 109.395 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.518 HG21 ' HD3' ' A' ' 31' ' ' ARG . 79.5 mt -106.28 111.29 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.218 -0.926 . . . . 0.0 110.111 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.523 ' O ' HG12 ' A' ' 29' ' ' VAL . 57.5 t -114.19 158.92 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.012 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.4 ' HG3' HG12 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -50.08 133.22 23.28 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.245 -0.909 . . . . 0.0 111.0 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 105.17 6.12 39.72 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 120.163 -1.017 . . . . 0.0 111.754 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.523 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.9 p -127.05 135.86 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 119.77 1.785 . . . . 0.0 110.476 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.427 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 8.2 t -87.72 140.61 29.34 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.115 -0.99 . . . . 0.0 109.975 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.518 ' HD3' HG21 ' A' ' 25' ' ' ILE . 13.0 ptt-85 -135.07 144.31 47.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.198 -0.939 . . . . 0.0 110.324 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.767 HG23 HG12 ' A' ' 8' ' ' VAL . 19.0 mt -108.82 122.56 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 109.351 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.18 162.44 15.24 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.454 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 12.3 pttp -127.86 140.9 51.74 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.277 -1.131 . . . . 0.0 109.405 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 46' ' ' ASP . 60.2 t -109.34 109.18 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.972 -1.08 . . . . 0.0 110.14 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.2 t -121.12 112.62 33.12 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.211 -0.93 . . . . 0.0 109.915 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.96 137.15 26.19 Favored 'Trans proline' 0 N--CA 1.486 1.059 0 O-C-N 123.118 1.062 . . . . 0.0 110.356 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 . . . . . 0 N--CA 1.5 2.036 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.813 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.456 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.407 ' HB3' HG13 ' A' ' 35' ' ' VAL . 0.7 OUTLIER -126.96 149.62 49.76 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.114 -1.227 . . . . 0.0 110.36 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.9 mtt -113.81 135.4 54.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.273 -0.892 . . . . 0.0 110.123 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.435 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 22.3 ttmt -121.75 135.37 54.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.17 -0.956 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -113.09 145.25 41.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.163 -0.96 . . . . 0.0 109.598 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.435 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 11.9 m95 -104.14 112.24 25.16 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.052 -1.03 . . . . 0.0 111.074 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -124.13 173.68 8.14 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.399 176.945 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 95.9 m-70 -93.41 177.66 5.96 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.475 -0.766 . . . . 0.0 110.693 -179.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.569 HG22 ' CE1' ' A' ' 93' ' ' HIS . 30.3 mt -77.24 -54.83 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -57.46 -38.03 73.82 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.032 -1.042 . . . . 0.0 109.695 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 18.8 m -62.3 -50.15 72.79 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.133 -0.979 . . . . 0.0 109.085 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.556 ' SD ' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -70.43 -44.83 67.09 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.388 -0.82 . . . . 0.0 109.522 179.648 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 53' ' ' ILE . 11.4 m-85 -64.47 -29.52 70.56 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.613 179.091 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -62.21 -42.05 98.94 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.854 -1.154 . . . . 0.0 109.091 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.4 -40.84 73.68 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.734 178.52 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.556 HD13 ' SD ' ' A' ' 56' ' ' MET . 0.3 OUTLIER -60.42 -41.88 94.88 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.262 -0.899 . . . . 0.0 108.882 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -60.11 -35.09 74.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.474 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.72 31.56 5.18 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.264 -0.897 . . . . 0.0 110.558 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.954 0 O-C-N 120.85 -1.156 . . . . 0.0 110.1 179.871 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 120.766 0.317 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.2 mt 54.86 101.02 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.172 -0.955 . . . . 0.0 110.782 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.23 135.6 44.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.144 -0.973 . . . . 0.0 109.452 179.171 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 54.64 -162.75 0.13 Allowed 'General case' 0 N--CA 1.502 2.138 0 O-C-N 120.944 -1.098 . . . . 0.0 109.977 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.615 HD13 ' OG1' ' A' ' 91' ' ' THR . 0.7 OUTLIER -132.48 39.08 3.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.022 -1.049 . . . . 0.0 110.602 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.03 35.87 0.84 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.206 -0.934 . . . . 0.0 110.481 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -133.65 37.26 3.3 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.099 -1.001 . . . . 0.0 109.923 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.874 HD22 ' HB3' ' A' ' 6' ' ' PHE . 96.5 mt -136.35 152.73 50.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.228 -0.92 . . . . 0.0 109.75 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -81.16 110.31 16.54 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.069 -1.019 . . . . 0.0 110.097 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.31 -34.75 1.61 Allowed Glycine 0 N--CA 1.494 2.544 0 C-N-CA 119.691 -1.242 . . . . 0.0 111.073 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.409 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 20.2 p-90 -63.95 -31.11 72.18 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.12 1.46 . . . . 0.0 110.759 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.0 tt0 -52.88 -35.17 57.52 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.829 -1.17 . . . . 0.0 110.596 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -82.64 -33.37 27.87 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.031 -1.043 . . . . 0.0 110.291 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.434 HD11 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -51.26 176.68 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.872 0 O-C-N 120.916 -1.115 . . . . 0.0 110.555 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -104.22 160.83 14.55 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.123 -0.986 . . . . 0.0 110.416 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.94 -43.33 95.06 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.197 -0.939 . . . . 0.0 110.313 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -61.62 -50.76 71.28 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.701 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.25 -38.59 89.84 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.481 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.811 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.3 ttpm? -60.52 -38.66 85.11 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.219 -0.926 . . . . 0.0 109.727 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -57.64 -38.19 74.63 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.195 -0.941 . . . . 0.0 110.049 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.26 -38.32 76.68 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.086 -1.009 . . . . 0.0 110.255 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.811 HD12 ' HA ' ' A' ' 87' ' ' LYS . 9.3 mt -64.66 -39.34 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 121.047 -1.033 . . . . 0.0 109.352 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.615 ' OG1' HD13 ' A' ' 73' ' ' LEU . 33.6 m -57.35 -39.54 76.14 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -56.86 -39.11 73.7 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.206 -0.934 . . . . 0.0 109.837 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.569 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.7 m-70 -61.9 -54.27 44.33 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.235 -0.916 . . . . 0.0 109.642 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.448 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.5 mp -62.77 -38.38 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.273 -0.971 . . . . 0.0 109.218 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -38.48 89.02 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.241 -0.912 . . . . 0.0 109.766 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -60.77 -46.67 89.56 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 109.541 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.7 mp -59.25 -35.12 73.12 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.271 -0.893 . . . . 0.0 110.014 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.0 m -102.41 69.64 1.12 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.16 -0.963 . . . . 0.0 110.169 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.0 t . . . . . 0 N--CA 1.499 1.983 0 O-C-N 121.094 -1.004 . . . . 0.0 110.04 179.703 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 N--CA 1.493 1.687 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -139.38 139.14 37.09 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.17 -0.956 . . . . 0.0 110.337 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.574 ' HE2' ' HH ' ' A' ' 51' ' ' TYR . 2.0 m-85 -115.98 146.63 41.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.254 -0.904 . . . . 0.0 109.999 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.4 m -130.16 159.59 36.36 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.218 -0.926 . . . . 0.0 109.189 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.867 ' CG1' HD23 ' A' ' 76' ' ' LEU . 22.8 m -125.69 105.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.019 -1.051 . . . . 0.0 111.061 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -100.44 141.74 32.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.949 -1.095 . . . . 0.0 109.576 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.465 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 46.8 m-85 -103.99 133.57 48.72 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.22 -0.925 . . . . 0.0 109.721 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.14 133.41 54.99 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -118.25 -58.28 2.0 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -153.68 39.23 0.48 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.168 -0.958 . . . . 0.0 110.642 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -139.25 171.63 23.59 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 m -145.08 127.25 15.69 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.198 -1.177 . . . . 0.0 110.476 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -149.17 143.83 26.2 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.206 -0.934 . . . . 0.0 110.813 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.19 128.0 44.78 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 108.749 -1.74 . . . . 0.0 108.749 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.783 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 32.0 p -64.35 122.55 16.96 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.222 -1.163 . . . . 0.0 110.811 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -68.34 157.25 36.09 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.349 -0.844 . . . . 0.0 108.838 179.69 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 15.79 10.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.842 -1.161 . . . . 0.0 111.83 -179.035 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.783 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.9 p -175.29 150.09 1.11 Allowed 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.566 -1.334 . . . . 0.0 110.699 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -86.85 89.13 7.86 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.008 -1.058 . . . . 0.0 111.784 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -165.66 -173.34 2.7 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.308 -0.87 . . . . 0.0 110.409 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -130.32 149.75 51.87 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.014 -1.054 . . . . 0.0 109.499 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.566 HG21 HH21 ' A' ' 31' ' ' ARG . 56.5 mt -102.7 134.35 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.263 -0.898 . . . . 0.0 110.006 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.9 m -136.6 169.2 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.267 -0.896 . . . . 0.0 110.322 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.19 127.33 10.44 Favored 'General case' 0 N--CA 1.516 2.857 0 O-C-N 121.583 -0.698 . . . . 0.0 110.948 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.53 8.81 48.58 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.097 -1.049 . . . . 0.0 111.156 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.1 t -111.2 135.65 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.547 1.673 . . . . 0.0 110.014 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.7 t -91.44 123.06 34.58 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.302 -0.874 . . . . 0.0 108.679 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.566 HH21 HG21 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -106.95 133.82 51.03 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.16 -0.963 . . . . 0.0 110.652 -179.351 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.782 HD11 HG12 ' A' ' 53' ' ' ILE . 6.2 mt -106.47 113.1 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.02 135.54 12.2 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 119.723 -1.227 . . . . 0.0 110.361 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.4 ttpm? -111.99 123.93 51.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -1.07 . . . . 0.0 108.986 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.593 HG22 ' HB3' ' A' ' 48' ' ' LYS . 52.2 t -109.29 108.99 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.132 -0.98 . . . . 0.0 110.272 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.402 HG13 ' HG2' ' A' ' 34' ' ' LYS . 33.2 m -123.6 146.94 51.59 Favored Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.215 -0.928 . . . . 0.0 110.24 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.87 146.25 33.0 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.393 1.207 . . . . 0.0 110.173 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.2 t30 . . . . . 0 N--CA 1.499 1.996 0 O-C-N 121.176 -0.953 . . . . 0.0 110.227 179.735 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.479 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -129.36 144.79 51.38 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.23 -1.159 . . . . 0.0 110.112 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 tpt -117.9 146.22 44.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.167 -0.958 . . . . 0.0 110.766 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.593 ' HB3' HG22 ' A' ' 35' ' ' VAL . 16.3 ptpt -131.87 144.78 51.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.24 -0.913 . . . . 0.0 109.671 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -135.56 145.37 46.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.037 -1.04 . . . . 0.0 110.45 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -97.85 115.86 28.91 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.166 -0.959 . . . . 0.0 110.53 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.574 ' HH ' ' HE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.8 171.36 11.29 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.073 -1.017 . . . . 0.0 109.989 177.859 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -88.44 163.04 16.16 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.782 HG12 HD11 ' A' ' 32' ' ' ILE . 33.4 mt -67.6 -48.12 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -61.14 -40.75 95.0 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.163 -0.961 . . . . 0.0 109.334 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.405 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 35.6 m -64.1 -44.64 91.7 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.268 179.171 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.491 ' CE ' HD12 ' A' ' 70' ' ' ILE . 5.5 ttp -72.44 -43.26 64.03 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.429 -0.795 . . . . 0.0 109.993 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.477 ' CD2' HG23 ' A' ' 53' ' ' ILE . 16.1 m-85 -71.86 -29.75 64.7 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.794 179.321 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -78.5 -39.5 38.04 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 120.787 -1.195 . . . . 0.0 109.244 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -73.2 -35.78 66.41 Favored 'General case' 0 N--CA 1.505 2.28 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.367 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 tp -73.37 -40.03 64.69 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.229 -0.919 . . . . 0.0 109.409 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.428 ' OE2' HD12 ' A' ' 97' ' ' LEU . 19.6 mt-10 -69.85 -27.46 64.86 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.061 -1.025 . . . . 0.0 110.349 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.22 -36.3 10.08 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.917 -1.114 . . . . 0.0 110.966 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.858 0 O-C-N 120.956 -1.09 . . . . 0.0 111.075 -179.412 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 30.1 tttp . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 120.66 0.267 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.491 HD12 ' CE ' ' A' ' 56' ' ' MET . 76.0 mt -114.59 99.01 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.237 -0.914 . . . . 0.0 109.814 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -108.84 132.91 53.56 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.293 -0.879 . . . . 0.0 109.801 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 51.24 -165.37 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.094 -1.004 . . . . 0.0 110.493 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.862 HD13 HG21 ' A' ' 90' ' ' ILE . 54.0 tp -122.0 84.22 2.22 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.102 -0.999 . . . . 0.0 110.032 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.469 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.5 OUTLIER -155.72 -54.85 0.09 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.236 -0.915 . . . . 0.0 110.964 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -47.73 -32.71 6.13 Favored 'General case' 0 N--CA 1.518 2.948 0 O-C-N 121.074 -1.016 . . . . 0.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.867 HD23 ' CG1' ' A' ' 8' ' ' VAL . 7.4 mp -72.69 153.18 41.31 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.054 -1.029 . . . . 0.0 110.218 179.67 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.541 ' O ' HG22 ' A' ' 8' ' ' VAL . 46.8 tt0 -99.65 136.46 39.55 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.266 -0.896 . . . . 0.0 110.697 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.514 ' O ' HD12 ' A' ' 82' ' ' LEU . . . 129.33 -35.07 2.66 Favored Glycine 0 N--CA 1.494 2.563 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 44.3 p-90 -67.29 -15.36 63.65 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 120.923 -1.34 . . . . 0.0 112.123 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -51.19 -37.67 47.94 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.556 -1.34 . . . . 0.0 111.356 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -169.3 54.89 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 120.979 -1.076 . . . . 0.0 112.071 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 78' ' ' GLY . 14.0 mt -111.4 -70.36 0.82 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 109.926 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -122.49 131.17 53.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.072 -1.017 . . . . 0.0 110.133 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -88.16 -50.68 6.22 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.081 -1.012 . . . . 0.0 109.966 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -66.55 -41.74 88.19 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.971 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.381 178.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.865 ' HA ' HD12 ' A' ' 90' ' ' ILE . 35.1 tttt -58.09 -38.93 77.35 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.117 -0.989 . . . . 0.0 109.879 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 2.8 tm-20 -60.93 -40.34 92.85 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.244 -0.91 . . . . 0.0 109.794 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.77 92.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.13 -0.981 . . . . 0.0 110.101 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.865 HD12 ' HA ' ' A' ' 87' ' ' LYS . 11.3 mt -62.19 -40.42 87.55 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 121.191 -0.943 . . . . 0.0 109.746 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 67.3 p -61.51 -39.13 89.87 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.123 -0.986 . . . . 0.0 109.94 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -58.88 -39.87 82.67 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.179 -0.951 . . . . 0.0 109.962 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.552 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.8 m-70 -58.6 -46.15 87.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.171 -0.956 . . . . 0.0 110.163 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.0 mp -61.96 -41.56 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.169 -0.957 . . . . 0.0 108.927 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.34 83.04 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.499 -0.881 . . . . 0.0 109.926 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -71.6 -38.31 70.86 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.136 -0.978 . . . . 0.0 109.81 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.428 HD12 ' OE2' ' A' ' 61' ' ' GLU . 38.0 tp -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.123 -0.985 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 39.5 t -91.89 -40.68 11.03 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.973 -1.079 . . . . 0.0 110.034 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.186 -0.946 . . . . 0.0 110.115 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 . . . . . 0 N--CA 1.494 1.731 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -142.36 145.79 34.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.218 -0.926 . . . . 0.0 110.381 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.778 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -116.69 147.04 42.34 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.193 -0.942 . . . . 0.0 110.202 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.8 t -128.01 148.24 50.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.329 -0.857 . . . . 0.0 108.884 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.841 HG12 HG23 ' A' ' 32' ' ' ILE . 16.9 m -128.82 109.47 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.063 -1.023 . . . . 0.0 110.824 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -123.47 161.46 24.81 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.11 -0.994 . . . . 0.0 110.69 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -102.39 155.64 18.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.495 -0.753 . . . . 0.0 110.072 179.901 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.33 140.01 30.35 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.357 -0.839 . . . . 0.0 110.019 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.3 mttm -114.88 -62.36 1.61 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.149 -0.97 . . . . 0.0 110.269 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -139.35 39.61 2.08 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.255 -0.903 . . . . 0.0 110.335 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.25 124.7 2.59 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.856 HG22 ' HA ' ' A' ' 26' ' ' VAL . 77.3 p -113.75 146.03 40.49 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.198 -1.178 . . . . 0.0 110.163 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -158.15 147.87 19.85 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.227 -0.921 . . . . 0.0 111.175 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.92 121.39 18.49 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 108.761 -1.735 . . . . 0.0 108.761 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.817 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 27.0 p -63.93 123.34 18.73 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.306 -1.114 . . . . 0.0 110.897 -178.326 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 46.8 mttt -71.59 156.05 39.84 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.577 -0.702 . . . . 0.0 109.256 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 65.51 16.01 10.31 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.875 -1.141 . . . . 0.0 111.638 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.817 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 13.0 p -174.74 150.48 1.32 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.592 -1.318 . . . . 0.0 110.534 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.5 92.28 9.12 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.476 -178.138 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.406 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 1.7 tt0 -167.65 -174.68 2.55 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 110.667 179.243 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -131.63 153.3 50.08 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.105 -0.997 . . . . 0.0 109.228 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.898 HG21 ' HD3' ' A' ' 31' ' ' ARG . 80.8 mt -107.91 139.28 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.195 -0.94 . . . . 0.0 110.592 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.856 ' HA ' HG22 ' A' ' 15' ' ' THR . 58.1 t -137.58 161.46 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.435 -0.791 . . . . 0.0 109.477 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -47.35 130.06 13.17 Favored 'General case' 0 N--CA 1.517 2.899 0 O-C-N 121.318 -0.864 . . . . 0.0 111.187 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 106.37 8.47 33.12 Favored Glycine 0 N--CA 1.496 2.667 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.992 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.684 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.8 p -124.38 136.09 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 CA-C-N 119.909 1.855 . . . . 0.0 110.441 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.7 t -83.67 141.84 31.2 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.187 -0.946 . . . . 0.0 109.959 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.898 ' HD3' HG21 ' A' ' 25' ' ' ILE . 27.7 mtm180 -119.47 146.6 45.27 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.148 -0.97 . . . . 0.0 110.743 -179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.841 HG23 HG12 ' A' ' 8' ' ' VAL . 5.4 mt -121.22 111.26 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.74 137.94 13.66 Favored Glycine 0 N--CA 1.494 2.54 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.116 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 6' ' ' PHE . 74.2 tttt -108.0 125.32 51.39 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.333 -1.098 . . . . 0.0 109.174 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.4 HG22 ' HB3' ' A' ' 48' ' ' LYS . 55.9 t -101.15 115.15 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.129 -0.982 . . . . 0.0 110.193 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.6 t -117.22 113.55 39.1 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.245 -0.909 . . . . 0.0 109.812 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.6 148.66 53.88 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 123.201 1.106 . . . . 0.0 110.481 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 N--CA 1.5 2.053 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 179.822 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.519 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.17 127.2 55.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.213 -1.169 . . . . 0.0 110.033 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 54.8 ttp -117.42 147.58 42.56 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.147 -0.971 . . . . 0.0 110.545 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HB3' HG22 ' A' ' 35' ' ' VAL . 11.8 pttm -131.3 143.77 50.78 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 109.857 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -120.43 136.23 54.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.155 -0.966 . . . . 0.0 110.026 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -91.89 112.95 25.08 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.052 -1.03 . . . . 0.0 110.362 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.516 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -125.91 172.05 10.22 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.889 177.494 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -89.63 172.61 8.83 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 119.792 -0.763 . . . . 0.0 110.681 -179.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.527 HG22 ' CE1' ' A' ' 93' ' ' HIS . 37.4 mt -72.83 -53.51 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.65 -39.35 80.33 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.011 -1.056 . . . . 0.0 109.838 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.8 m -62.73 -46.65 87.09 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.116 -0.99 . . . . 0.0 109.486 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.453 ' O ' HD13 ' A' ' 60' ' ' LEU . 12.4 tpt -74.25 -42.75 59.15 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.285 -0.885 . . . . 0.0 109.933 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.525 ' CD2' HG23 ' A' ' 53' ' ' ILE . 20.6 m-85 -70.16 -25.9 63.67 Favored 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 119.214 -0.994 . . . . 0.0 110.044 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -73.74 -38.73 64.65 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.741 -1.224 . . . . 0.0 109.358 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -63.73 -41.82 97.99 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.123 -0.986 . . . . 0.0 109.411 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 56' ' ' MET . 7.4 mp -59.97 -41.09 91.23 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.357 -0.84 . . . . 0.0 109.826 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -66.32 -35.19 79.75 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.25 -0.906 . . . . 0.0 110.496 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -79.78 -36.77 36.64 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.089 -1.007 . . . . 0.0 110.237 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.822 0 O-C-N 121.09 -1.006 . . . . 0.0 110.117 179.809 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.9 mttt . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.3 mt 53.17 92.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.036 -1.04 . . . . 0.0 110.319 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -110.57 136.74 49.23 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.194 -0.941 . . . . 0.0 110.022 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.33 -167.09 0.07 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.03 -1.044 . . . . 0.0 110.464 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 1.105 HD22 HG23 ' A' ' 91' ' ' THR . 14.9 tp -117.02 38.56 3.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.194 -0.941 . . . . 0.0 110.791 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.23 37.11 0.84 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.164 -0.96 . . . . 0.0 110.535 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -131.64 37.32 3.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.206 -0.934 . . . . 0.0 109.894 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.778 HD22 ' HB3' ' A' ' 6' ' ' PHE . 92.0 mt -140.43 152.95 46.1 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.186 -0.947 . . . . 0.0 109.79 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -84.69 98.85 10.45 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.159 -0.963 . . . . 0.0 110.186 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 153.45 -36.19 0.75 Allowed Glycine 0 N--CA 1.495 2.615 0 C-N-CA 119.65 -1.262 . . . . 0.0 110.99 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.404 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 27.4 p-90 -57.94 -29.79 65.44 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 120.928 -1.336 . . . . 0.0 111.029 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -52.41 -36.72 54.9 Favored 'General case' 0 N--CA 1.515 2.794 0 O-C-N 120.861 -1.15 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.59 -33.06 41.96 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.161 -0.962 . . . . 0.0 110.243 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.06 170.3 0.02 OUTLIER 'General case' 0 N--CA 1.518 2.94 0 O-C-N 121.024 -1.048 . . . . 0.0 110.934 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -107.56 161.13 15.12 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.177 -0.952 . . . . 0.0 110.515 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.92 -42.72 90.34 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.214 -0.929 . . . . 0.0 110.258 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -61.79 -51.94 66.24 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.264 -0.898 . . . . 0.0 109.483 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.402 ' OE2' ' CZ ' ' A' ' 10' ' ' TYR . 40.8 mt-10 -63.72 -40.0 95.67 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.006 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.548 ' HA ' HD12 ' A' ' 90' ' ' ILE . 13.3 ttpt -59.43 -38.35 80.46 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.351 -0.843 . . . . 0.0 109.845 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -63.21 -36.61 84.2 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.185 -0.947 . . . . 0.0 110.151 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -68.93 -38.29 79.4 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.07 -1.019 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.548 ' CG2' HD11 ' A' ' 73' ' ' LEU . 9.3 mt -68.74 -38.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.409 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' THR . . . . . 1.105 HG23 HD22 ' A' ' 73' ' ' LEU . 1.8 p -59.01 -37.71 77.55 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.946 -1.096 . . . . 0.0 109.521 178.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -56.4 -37.8 70.64 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.22 -0.925 . . . . 0.0 109.814 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.527 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.61 -54.35 48.09 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.125 -0.984 . . . . 0.0 109.711 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.453 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 9.4 mt -64.79 -39.34 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 C-N-CA 119.399 -0.92 . . . . 0.0 108.984 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.64 87.14 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.409 -0.916 . . . . 0.0 109.504 178.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.6 -49.23 77.42 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.075 -1.016 . . . . 0.0 109.341 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.65 -36.46 78.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.265 -0.897 . . . . 0.0 109.971 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.7 t -103.46 69.54 1.0 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.142 -0.973 . . . . 0.0 110.086 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.6 p . . . . . 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.0 110.162 179.941 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 . . . . . 0 N--CA 1.494 1.746 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.8 ttt85 -142.24 144.88 33.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.122 -0.986 . . . . 0.0 110.349 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.829 ' HB3' HD22 ' A' ' 76' ' ' LEU . 2.1 m-85 -117.71 140.58 49.48 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.206 -0.934 . . . . 0.0 110.203 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.3 t -130.97 125.51 33.57 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.172 -0.955 . . . . 0.0 109.372 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 1.079 HG12 HG23 ' A' ' 32' ' ' ILE . 11.1 m -103.66 134.23 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.135 -0.978 . . . . 0.0 110.352 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.32 108.11 5.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.195 -0.94 . . . . 0.0 110.318 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.772 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -51.02 157.47 0.84 Allowed 'General case' 0 N--CA 1.514 2.752 0 O-C-N 121.135 -0.978 . . . . 0.0 110.528 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.514 ' HB1' ' H ' ' A' ' 27' ' ' LYS . . . -83.44 139.99 32.63 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.306 -0.872 . . . . 0.0 110.002 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -127.46 -58.47 1.26 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.222 -0.924 . . . . 0.0 110.501 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.22 140.53 26.64 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.17 -0.956 . . . . 0.0 110.328 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.31 149.14 16.73 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -116.07 128.52 55.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.19 -1.183 . . . . 0.0 109.938 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.43 131.38 29.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.125 -0.985 . . . . 0.0 110.948 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.6 124.02 35.07 Favored Glycine 0 N--CA 1.493 2.495 0 N-CA-C 108.284 -1.927 . . . . 0.0 108.284 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 22.3 p -64.93 125.78 25.93 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.181 -1.188 . . . . 0.0 111.005 -178.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 157.38 37.26 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.667 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 16.8 10.71 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.878 -1.139 . . . . 0.0 111.395 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.6 p -177.75 152.42 0.78 Allowed 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.564 -1.335 . . . . 0.0 110.548 178.178 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -89.57 92.12 8.96 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.992 -1.067 . . . . 0.0 111.541 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.431 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.93 -173.61 2.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.401 -0.812 . . . . 0.0 110.325 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -139.19 148.99 43.89 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.014 -1.054 . . . . 0.0 109.911 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.45 ' CG2' ' HB2' ' A' ' 11' ' ' ALA . 6.9 mt -112.25 131.0 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.174 -0.954 . . . . 0.0 109.7 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.62 ' O ' HG13 ' A' ' 26' ' ' VAL . 8.6 p -155.68 84.25 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.138 -0.976 . . . . 0.0 111.28 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.514 ' H ' ' HB1' ' A' ' 11' ' ' ALA . 0.5 OUTLIER 48.7 101.91 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.367 -0.833 . . . . 0.0 112.406 178.812 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 138.0 -22.03 3.13 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 119.392 -1.385 . . . . 0.0 112.219 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p -125.62 139.41 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 CA-C-N 119.737 1.769 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -80.18 141.6 35.51 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.202 -0.936 . . . . 0.0 109.81 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.438 ' HD3' HD13 ' A' ' 25' ' ' ILE . 2.8 ptt85 -129.5 143.74 50.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.225 -0.922 . . . . 0.0 110.276 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 1.079 HG23 HG12 ' A' ' 8' ' ' VAL . 12.3 mt -111.11 126.48 68.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.186 -0.946 . . . . 0.0 109.181 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.9 154.15 16.72 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.491 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 11.3 pttp -127.8 143.43 51.13 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.129 -1.218 . . . . 0.0 109.589 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.3 t -108.53 109.66 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.012 -1.055 . . . . 0.0 109.949 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.9 t -115.39 113.22 43.29 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.186 -0.947 . . . . 0.0 109.829 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.17 150.09 53.01 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 O-C-N 123.196 1.103 . . . . 0.0 110.427 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 . . . . . 0 N--CA 1.499 2.024 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 179.845 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.447 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -146.25 130.06 17.15 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.191 -1.182 . . . . 0.0 110.173 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.6 mtt -117.96 128.22 54.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.133 -0.979 . . . . 0.0 110.588 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -126.83 123.08 36.52 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.171 -0.956 . . . . 0.0 109.792 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -118.27 142.6 47.32 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.134 -0.978 . . . . 0.0 110.411 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -99.25 114.1 26.74 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.173 -0.954 . . . . 0.0 110.611 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.519 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.3 OUTLIER -124.79 174.15 8.11 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.018 -1.051 . . . . 0.0 109.811 177.495 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.499 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 64.4 m80 -92.92 -173.7 3.37 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.454 -0.779 . . . . 0.0 110.664 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.611 HG22 ' CE1' ' A' ' 93' ' ' HIS . 37.9 mm -82.93 -56.63 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -58.56 -38.74 78.49 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.18 -0.95 . . . . 0.0 109.49 178.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.9 m -60.33 -51.31 70.07 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.272 -0.893 . . . . 0.0 109.104 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.467 ' HG2' HD11 ' A' ' 70' ' ' ILE . 10.5 tpt -68.8 -45.42 71.31 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.446 -0.784 . . . . 0.0 109.374 179.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 93' ' ' HIS . 9.5 m-85 -63.07 -30.24 71.44 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.244 -0.983 . . . . 0.0 109.949 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -65.7 -42.13 91.53 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.847 -1.158 . . . . 0.0 109.034 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -65.58 -41.04 93.33 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.277 -0.889 . . . . 0.0 108.979 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 56' ' ' MET . 7.5 mp -55.34 -41.02 71.94 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.139 -0.976 . . . . 0.0 109.152 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.11 -33.91 65.55 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.287 -0.883 . . . . 0.0 109.562 178.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -104.57 30.82 5.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.147 -0.97 . . . . 0.0 110.396 179.097 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.885 0 O-C-N 120.969 -1.082 . . . . 0.0 110.109 179.963 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 120.681 0.276 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.908 HG23 HD11 ' A' ' 76' ' ' LEU . 80.0 mt 54.14 99.11 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.178 -0.951 . . . . 0.0 110.797 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.9 132.35 54.28 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.0 109.729 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.94 -164.17 0.07 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.023 -1.048 . . . . 0.0 110.777 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.728 HD23 ' HE2' ' A' ' 87' ' ' LYS . 46.0 tp -114.02 -55.42 2.5 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.97 -36.99 60.82 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.014 -1.054 . . . . 0.0 110.724 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -50.62 -31.07 14.99 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.057 -1.027 . . . . 0.0 111.302 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.908 HD11 HG23 ' A' ' 70' ' ' ILE . 89.0 mt -87.35 152.19 22.48 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.889 -1.132 . . . . 0.0 110.305 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -96.31 137.13 35.84 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.243 -0.911 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.56 -49.44 0.85 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.447 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 55.6 p-90 -50.81 -32.0 18.75 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.116 -1.226 . . . . 0.0 111.151 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 3.8 tm-20 -53.52 -28.04 29.09 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.94 -1.1 . . . . 0.0 111.416 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -110.05 24.22 13.3 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.878 -1.139 . . . . 0.0 112.244 -179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.772 HD13 ' CD2' ' A' ' 10' ' ' TYR . 21.6 mt -111.1 -164.8 0.94 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.723 -1.235 . . . . 0.0 109.678 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -88.02 161.85 17.14 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.926 -1.109 . . . . 0.0 110.312 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.13 -49.26 17.81 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.923 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -61.92 -42.7 99.39 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.305 -0.872 . . . . 0.0 109.366 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 21.3 mt-10 -62.58 -40.62 97.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.728 ' HE2' HD23 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -59.3 -39.81 84.19 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.208 -0.932 . . . . 0.0 109.932 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -58.36 -39.69 80.23 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.247 -0.908 . . . . 0.0 110.062 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -59.47 -35.82 74.82 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.6 HG22 HD13 ' A' ' 73' ' ' LEU . 47.9 mm -70.46 -38.39 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.1 -1.0 . . . . 0.0 109.434 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -38.86 92.82 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.031 -1.043 . . . . 0.0 109.391 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -57.23 -35.8 70.13 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.163 -0.961 . . . . 0.0 110.016 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.611 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.7 m-70 -55.57 -50.01 71.21 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.05 -1.031 . . . . 0.0 109.941 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.74 -38.24 81.81 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.314 -0.954 . . . . 0.0 109.15 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.8 -39.63 83.97 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.575 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.43 -39.92 94.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.19 -0.944 . . . . 0.0 109.414 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -82.52 -34.77 27.79 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.9 m -103.69 60.56 0.75 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.133 -0.979 . . . . 0.0 109.983 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.496 1.866 0 O-C-N 121.053 -1.03 . . . . 0.0 110.25 179.906 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 120.586 0.232 . . . . 0.0 110.456 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 -133.69 138.73 46.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.141 -0.974 . . . . 0.0 110.344 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.603 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -131.55 141.04 49.61 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.291 -0.881 . . . . 0.0 109.675 179.986 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.438 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.8 m -152.69 166.72 31.26 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.33 -0.856 . . . . 0.0 109.956 179.199 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.712 HG22 ' HB2' ' A' ' 77' ' ' GLU . 6.1 m -104.64 141.4 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 120.864 -1.148 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.436 ' CB ' ' CZ3' ' A' ' 50' ' ' TRP . 10.1 t0 -136.91 147.92 46.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.298 -0.877 . . . . 0.0 109.261 179.224 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.64 ' CD2' HD13 ' A' ' 82' ' ' LEU . 59.9 m-85 -102.48 154.29 19.23 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.22 -0.925 . . . . 0.0 110.311 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.08 133.9 34.21 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.26 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -134.15 106.06 6.98 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 52.97 95.07 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.041 -1.037 . . . . 0.0 110.806 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.6 144.38 4.81 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.709 -1.356 . . . . 0.0 109.709 179.904 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 p -117.77 134.49 54.86 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.219 -1.165 . . . . 0.0 110.125 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.83 134.35 49.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.189 -0.944 . . . . 0.0 110.721 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.82 124.62 31.18 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . 22.4 t -62.41 128.53 36.47 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.355 -1.086 . . . . 0.0 109.337 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 145.94 47.97 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.5 mttt 52.58 48.74 21.89 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.901 -1.124 . . . . 0.0 109.732 -179.231 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.69 151.42 9.2 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.351 -0.843 . . . . 0.0 110.656 -178.328 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -101.93 49.76 0.85 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.138 -0.976 . . . . 0.0 108.57 178.525 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.6 -174.1 4.23 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.474 -0.766 . . . . 0.0 110.18 -178.833 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -133.31 159.66 39.61 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.118 -0.989 . . . . 0.0 109.914 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.407 HG21 ' HD2' ' A' ' 31' ' ' ARG . 62.9 mt -104.51 105.02 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.409 -0.807 . . . . 0.0 109.526 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.732 ' O ' HG12 ' A' ' 29' ' ' VAL . 12.8 p -104.65 161.66 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.188 -0.945 . . . . 0.0 110.583 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -46.13 138.57 5.17 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.466 -0.771 . . . . 0.0 111.195 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.02 0.77 51.64 Favored Glycine 0 N--CA 1.493 2.466 0 C-N-CA 120.163 -1.018 . . . . 0.0 111.036 -179.202 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.732 HG12 ' O ' ' A' ' 26' ' ' VAL . 10.4 p -125.62 135.58 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-N 119.549 1.674 . . . . 0.0 109.86 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.651 ' HB3' HD11 ' A' ' 53' ' ' ILE . 21.0 t -89.44 138.84 31.09 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 -179.609 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.407 ' HD2' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -127.45 154.1 45.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.334 -0.854 . . . . 0.0 110.138 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.468 HD12 ' CG ' ' A' ' 56' ' ' MET . 20.8 mt -102.07 136.53 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.18 -0.95 . . . . 0.0 110.185 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.439 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.1 126.0 8.51 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.574 -1.81 . . . . 0.0 108.574 179.183 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 74.8 tttt -105.13 114.62 28.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.177 -1.19 . . . . 0.0 109.742 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -96.04 121.2 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.212 -0.93 . . . . 0.0 110.429 -179.795 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.7 t -119.86 110.75 36.39 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.215 -0.928 . . . . 0.0 109.417 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.03 147.61 43.49 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.24 1.126 . . . . 0.0 110.638 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.8 m120 . . . . . 0 N--CA 1.499 2.014 0 O-C-N 121.268 -0.895 . . . . 0.0 110.006 179.705 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.586 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -143.56 142.47 31.11 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.175 -1.191 . . . . 0.0 110.299 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.6 mtt -116.39 140.59 49.18 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.21 -0.931 . . . . 0.0 110.148 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -129.75 122.64 29.27 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.133 -0.979 . . . . 0.0 110.54 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -116.65 145.45 43.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.142 -0.974 . . . . 0.0 109.694 179.62 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.439 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 16.6 m95 -97.37 139.82 32.75 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.108 -0.995 . . . . 0.0 110.084 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -125.43 173.19 9.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 110.064 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 1.7 m80 -90.91 -172.67 3.43 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.526 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.975 HG22 ' CE1' ' A' ' 93' ' ' HIS . 44.5 mm -84.79 -40.29 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 120.962 -1.086 . . . . 0.0 109.161 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -86.45 -31.11 21.55 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.997 -1.064 . . . . 0.0 110.634 178.905 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 78.9 m -66.56 -51.01 61.17 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.951 -1.093 . . . . 0.0 109.923 179.807 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.468 ' CG ' HD12 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -66.22 -40.21 90.14 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.007 -179.716 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.488 ' CD2' ' CD2' ' A' ' 93' ' ' HIS . 5.8 m-85 -70.44 -32.62 70.28 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 118.938 -1.105 . . . . 0.0 109.553 178.956 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.96 -36.97 78.25 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.97 -1.081 . . . . 0.0 109.592 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -59.29 -40.18 85.33 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.122 -0.986 . . . . 0.0 109.787 179.469 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -57.72 -42.66 84.28 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.194 -0.942 . . . . 0.0 109.327 179.286 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.95 -34.04 71.31 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.625 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -107.55 31.01 5.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.19 -0.944 . . . . 0.0 110.639 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.891 0 O-C-N 120.995 -1.066 . . . . 0.0 110.136 179.854 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.8 mttt . . . . . 0 N--CA 1.494 1.761 0 CA-C-O 120.708 0.29 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.778 ' HA ' HD21 ' A' ' 76' ' ' LEU . 74.5 mt 54.36 98.74 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.14 -0.975 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -112.82 137.55 50.99 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.086 -1.009 . . . . 0.0 109.996 179.585 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.42 -164.04 0.09 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.998 -1.063 . . . . 0.0 110.704 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.64 HD22 ' OG1' ' A' ' 91' ' ' THR . 56.6 tp -112.87 160.32 18.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.104 -0.997 . . . . 0.0 110.137 -179.778 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.445 HG23 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER 60.36 46.24 10.23 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.037 -1.039 . . . . 0.0 110.178 -179.829 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.767 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.8 mm-40 -112.91 -62.27 1.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.142 -0.974 . . . . 0.0 109.537 179.348 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.778 HD21 ' HA ' ' A' ' 70' ' ' ILE . 0.9 OUTLIER -138.3 65.62 1.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.266 -0.896 . . . . 0.0 109.491 178.732 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.712 ' HB2' HG22 ' A' ' 8' ' ' VAL . 10.2 pt-20 -143.01 141.87 31.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.858 -1.151 . . . . 0.0 110.956 179.492 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.76 68.54 1.89 Allowed Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.186 -1.566 . . . . 0.0 109.186 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.445 ' CE2' HG23 ' A' ' 74' ' ' THR . 58.6 p-90 -91.81 -32.87 15.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.147 -1.208 . . . . 0.0 111.207 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -52.54 -29.42 25.34 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.838 -1.164 . . . . 0.0 111.17 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -94.86 -38.73 10.6 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.852 -1.155 . . . . 0.0 110.618 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.64 HD13 ' CD2' ' A' ' 10' ' ' TYR . 92.5 mt -70.67 -175.69 1.13 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.949 -1.095 . . . . 0.0 110.015 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -63.91 150.13 45.67 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.225 -0.922 . . . . 0.0 110.16 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -88.45 -39.95 13.85 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.246 -0.909 . . . . 0.0 110.32 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -58.03 -40.82 81.83 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 121.245 -0.909 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.431 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.4 mt-10 -59.78 -39.56 85.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.285 -0.884 . . . . 0.0 109.764 179.624 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.447 ' HG2' HD21 ' A' ' 73' ' ' LEU . 3.8 ttpm? -58.69 -38.52 78.41 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.185 -0.947 . . . . 0.0 110.09 179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -59.06 -45.69 90.15 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.733 179.738 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -59.17 -34.24 71.87 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.224 -0.922 . . . . 0.0 110.164 179.299 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.5 mm -58.9 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.056 -1.028 . . . . 0.0 109.439 179.419 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.64 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -57.69 -41.38 81.53 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.095 -1.003 . . . . 0.0 109.649 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -62.56 -41.55 98.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.214 179.207 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.975 ' CE1' HG22 ' A' ' 53' ' ' ILE . 72.9 t60 -60.65 -46.47 90.18 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.266 -0.896 . . . . 0.0 109.567 179.541 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.457 HG12 ' CE1' ' A' ' 57' ' ' PHE . 25.7 mt -62.41 -39.5 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.181 -0.95 . . . . 0.0 109.396 179.422 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.403 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -60.47 -39.97 89.57 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.202 -0.936 . . . . 0.0 109.717 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -61.44 -44.22 97.5 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.261 -0.9 . . . . 0.0 109.345 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.469 HD22 ' HD1' ' A' ' 57' ' ' PHE . 5.0 tp -60.23 -35.1 74.68 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.353 -0.842 . . . . 0.0 110.035 179.385 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.0 t -100.59 67.29 1.28 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.053 -1.029 . . . . 0.0 110.077 179.822 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 8.4 m . . . . . 0 N--CA 1.493 1.705 0 O-C-N 121.115 -0.991 . . . . 0.0 110.184 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 . . . . . 0 N--CA 1.495 1.793 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -125.24 153.79 42.63 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.222 -0.924 . . . . 0.0 110.393 -179.92 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.525 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.6 OUTLIER -146.13 134.85 22.28 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.344 -0.848 . . . . 0.0 109.866 -179.943 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 p -152.73 165.49 35.13 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.052 -1.03 . . . . 0.0 109.871 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.614 HG22 ' HB2' ' A' ' 77' ' ' GLU . 11.1 m -101.81 116.23 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 120.91 -1.119 . . . . 0.0 110.606 179.618 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -105.0 141.78 35.97 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.019 -1.051 . . . . 0.0 109.239 179.057 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 83' ' ' GLU . 73.2 m-85 -100.35 152.14 20.67 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.156 -0.965 . . . . 0.0 110.192 -179.793 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -100.68 135.54 41.96 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.363 -0.836 . . . . 0.0 110.025 179.664 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 mtpt -114.18 -55.1 2.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.146 -0.971 . . . . 0.0 110.348 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -133.8 156.13 48.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.185 -0.947 . . . . 0.0 110.256 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 162.61 24.13 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.803 HG23 ' O ' ' A' ' 25' ' ' ILE . 89.4 m -138.31 145.42 41.2 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.226 -1.161 . . . . 0.0 110.192 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -140.92 141.85 34.49 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.218 -0.926 . . . . 0.0 110.736 -179.835 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.41 127.58 44.14 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.33 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.807 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 31.3 p -65.74 121.65 15.48 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.148 -1.207 . . . . 0.0 110.931 -178.425 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 29.7 mmtt -66.89 156.32 36.08 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.335 -0.853 . . . . 0.0 108.972 179.717 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.84 16.35 10.41 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.84 -1.163 . . . . 0.0 111.92 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.807 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.4 p -175.24 149.33 1.05 Allowed 'General case' 0 N--CA 1.504 2.256 0 O-C-N 120.571 -1.33 . . . . 0.0 110.726 178.095 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -86.64 88.36 7.65 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.021 -1.049 . . . . 0.0 111.678 -178.021 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.406 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.1 tt0 -165.27 -173.73 2.96 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 179.01 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -130.81 153.8 48.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.019 -1.051 . . . . 0.0 109.833 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.803 ' O ' HG23 ' A' ' 15' ' ' THR . 87.4 mt -107.73 122.5 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.277 -0.889 . . . . 0.0 109.969 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.474 HG22 ' HG2' ' A' ' 27' ' ' LYS . 12.2 p -120.09 160.3 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.243 -0.911 . . . . 0.0 110.323 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HG22 ' A' ' 26' ' ' VAL . 3.7 pttt -47.83 132.04 14.84 Favored 'General case' 0 N--CA 1.515 2.821 0 O-C-N 121.386 -0.821 . . . . 0.0 111.28 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.4 8.59 40.53 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.117 -1.039 . . . . 0.0 111.727 -179.915 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.472 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.7 p -124.97 137.01 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-N 119.723 1.762 . . . . 0.0 110.612 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.1 t -94.43 133.46 38.01 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.161 -0.962 . . . . 0.0 109.942 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.24 148.61 50.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.266 -0.896 . . . . 0.0 110.151 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.42 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 10.1 mt -104.36 123.89 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.083 -1.01 . . . . 0.0 109.425 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.446 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -106.02 143.93 15.77 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 179.569 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.463 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 27.4 tttt -108.37 117.17 33.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -1.136 . . . . 0.0 108.774 179.679 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -96.4 108.7 21.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.01 -1.056 . . . . 0.0 110.467 -179.421 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 37' ' ' PRO . 9.0 p -123.62 143.43 41.7 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.301 -0.874 . . . . 0.0 110.041 179.354 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 36' ' ' VAL . 49.8 Cg_endo -76.22 143.77 25.69 Favored 'Trans proline' 0 C--N 1.317 -1.084 0 O-C-N 123.101 1.053 . . . . 0.0 110.342 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.9 m120 . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.189 -0.944 . . . . 0.0 110.088 179.783 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.497 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -132.77 151.42 52.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.205 -1.173 . . . . 0.0 110.038 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.6 ttp -113.6 130.99 56.28 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.226 -0.921 . . . . 0.0 110.53 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -139.15 136.77 35.46 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.948 . . . . 0.0 110.084 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -122.1 153.48 38.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.174 -0.954 . . . . 0.0 109.399 179.856 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 16.1 m95 -107.5 114.1 27.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.109 -0.994 . . . . 0.0 111.033 -179.872 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -123.35 171.32 9.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.193 -0.942 . . . . 0.0 109.224 177.412 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 -86.72 -175.19 5.32 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.269 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.513 HG22 ' ND1' ' A' ' 93' ' ' HIS . 31.9 mm -85.33 -47.06 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 178.211 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -64.85 -40.01 94.46 Favored 'General case' 0 N--CA 1.504 2.234 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.056 178.126 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 51.1 m -62.09 -45.99 91.04 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.084 179.071 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.418 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -70.19 -46.65 64.15 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.414 -0.804 . . . . 0.0 109.661 179.86 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -67.13 -28.96 68.58 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.975 179.368 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -76.83 -42.74 39.15 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.777 -1.202 . . . . 0.0 108.899 178.545 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.2 tptp -66.77 -39.76 87.98 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.42 -0.912 . . . . 0.0 108.796 178.415 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.587 HD21 ' CB ' ' A' ' 69' ' ' LYS . 6.0 tp -55.74 -41.22 73.61 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.256 -0.902 . . . . 0.0 109.21 178.79 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -59.75 -34.86 73.5 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.288 -0.883 . . . . 0.0 109.555 178.542 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 -108.77 32.65 4.72 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.145 -0.972 . . . . 0.0 110.538 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.213 0 O-C-N 120.954 -1.092 . . . . 0.0 110.305 179.946 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.587 ' CB ' HD21 ' A' ' 60' ' ' LEU . 18.1 mtmt . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 120.799 0.333 . . . . 0.0 110.563 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.2 mt -111.37 120.2 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.696 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -114.05 152.78 30.5 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.273 -0.892 . . . . 0.0 109.724 179.583 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 52.86 -165.23 0.07 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.027 -1.046 . . . . 0.0 110.487 -179.753 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 1.044 HD11 HG22 ' A' ' 90' ' ' ILE . 1.6 tp -138.02 -164.78 1.68 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.147 -0.971 . . . . 0.0 110.162 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.58 HG22 ' CE2' ' A' ' 79' ' ' TRP . 4.5 p 46.84 43.3 13.13 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.169 -0.957 . . . . 0.0 111.204 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.777 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.1 tp10 -113.43 -55.84 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.251 -0.905 . . . . 0.0 110.055 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.777 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.3 pt? -146.59 63.42 1.2 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.082 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.614 ' HB2' HG22 ' A' ' 8' ' ' VAL . 5.2 pt-20 -144.46 141.28 29.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.063 -1.023 . . . . 0.0 110.699 178.888 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.08 66.2 3.46 Favored Glycine 0 N--CA 1.496 2.672 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.439 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.58 ' CE2' HG22 ' A' ' 74' ' ' THR . 51.1 p-90 -90.91 -39.22 12.41 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.073 -1.251 . . . . 0.0 110.512 179.865 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.86 -24.13 67.44 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.227 -0.921 . . . . 0.0 111.072 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -95.96 -29.63 14.06 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.714 -1.241 . . . . 0.0 111.497 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.1 mt -94.77 -79.79 0.42 Allowed 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.8 -1.187 . . . . 0.0 110.773 -179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 5.8 mt-10 -125.39 132.62 52.74 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.7 -1.25 . . . . 0.0 110.829 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -89.07 -43.94 10.72 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.13 -0.981 . . . . 0.0 109.554 178.978 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -62.02 -40.99 97.56 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.365 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -56.08 -38.99 71.43 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.219 -0.925 . . . . 0.0 109.683 179.058 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.852 ' HA ' HD12 ' A' ' 90' ' ' ILE . 1.3 ttpt -55.53 -38.17 68.9 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.08 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.4 -44.17 97.61 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 109.607 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -64.11 -39.07 93.25 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.261 -0.899 . . . . 0.0 109.883 179.633 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 1.044 HG22 HD11 ' A' ' 73' ' ' LEU . 12.6 mt -61.41 -35.1 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.219 -0.925 . . . . 0.0 109.546 179.367 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.451 ' OG1' HD22 ' A' ' 73' ' ' LEU . 3.7 m -60.77 -38.95 86.99 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.812 -1.18 . . . . 0.0 109.576 179.134 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -57.13 -38.53 73.6 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.266 -0.896 . . . . 0.0 109.901 179.395 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.513 ' ND1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -53.05 -43.47 66.68 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.06 -1.025 . . . . 0.0 110.178 179.753 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.461 HD13 HD13 ' A' ' 73' ' ' LEU . 1.5 mp -65.97 -40.55 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.323 -0.951 . . . . 0.0 108.873 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.49 -36.95 81.93 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.969 179.312 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -70.63 -37.75 73.83 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.2 tp -79.73 -31.94 41.12 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.046 -1.034 . . . . 0.0 110.736 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.3 m -92.04 -39.48 11.62 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.192 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 N--CA 1.494 1.748 0 O-C-N 121.081 -1.012 . . . . 0.0 110.1 179.885 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -141.97 135.18 29.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.178 -0.951 . . . . 0.0 110.228 -179.913 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.777 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.1 m-85 -118.37 137.55 53.04 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.212 -0.93 . . . . 0.0 110.127 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.419 ' O ' HG23 ' A' ' 32' ' ' ILE . 11.7 m -122.78 159.47 27.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.186 -0.946 . . . . 0.0 109.295 179.511 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.521 HG12 HG23 ' A' ' 32' ' ' ILE . 25.8 m -130.08 116.17 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.038 -1.038 . . . . 0.0 110.311 179.577 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.16 151.82 37.66 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.999 -1.063 . . . . 0.0 110.298 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.676 ' HB2' HD22 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -104.97 144.77 31.35 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.309 -0.87 . . . . 0.0 109.602 179.739 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.03 113.35 25.02 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.168 -0.957 . . . . 0.0 110.386 -179.762 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -113.48 -56.06 2.45 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.236 -0.915 . . . . 0.0 109.886 179.733 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.2 ttm-85 -125.52 39.02 4.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.178 -0.951 . . . . 0.0 110.133 179.768 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.12 155.06 25.94 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 t -146.59 146.03 30.3 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.286 -1.126 . . . . 0.0 110.279 179.984 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -156.08 149.01 24.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.193 -0.942 . . . . 0.0 111.589 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.96 125.88 41.02 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.09 140.9 56.57 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.309 -1.112 . . . . 0.0 110.361 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HB2' ' HB3' ' A' ' 49' ' ' GLU . 0.5 OUTLIER -88.99 153.8 20.72 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.944 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.36 33.01 22.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.84 -1.163 . . . . 0.0 109.664 -178.761 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 132.0 0.09 Allowed 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.772 -1.205 . . . . 0.0 109.372 -179.768 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.36 72.61 4.9 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.07 -1.019 . . . . 0.0 109.91 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -151.33 -175.52 5.21 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.247 -0.908 . . . . 0.0 110.318 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -133.38 156.83 46.95 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.914 -1.116 . . . . 0.0 109.756 -179.27 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.604 HD11 ' O ' ' A' ' 50' ' ' TRP . 56.4 mt -105.03 114.95 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.344 -0.847 . . . . 0.0 109.617 179.929 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.623 ' O ' HG12 ' A' ' 29' ' ' VAL . 58.9 t -110.61 160.93 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.21 -0.931 . . . . 0.0 110.3 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -47.11 144.75 2.48 Favored 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.406 -0.809 . . . . 0.0 111.125 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 90.17 9.67 65.17 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.072 -1.061 . . . . 0.0 111.068 -179.35 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.5 p -125.1 133.95 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 119.485 1.642 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 25.4 p -89.99 139.04 30.99 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.167 -0.958 . . . . 0.0 110.0 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.09 150.67 52.04 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.238 -0.913 . . . . 0.0 110.616 -179.68 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.521 HG23 HG12 ' A' ' 8' ' ' VAL . 20.5 mt -113.32 134.46 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.288 -0.883 . . . . 0.0 109.537 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.78 127.92 9.16 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.473 ' CB ' ' OH ' ' A' ' 51' ' ' TYR . 17.5 tttp -103.15 118.36 36.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.128 -1.219 . . . . 0.0 109.585 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.462 HG22 ' HB2' ' A' ' 48' ' ' LYS . 47.2 t -94.31 119.2 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.175 -0.953 . . . . 0.0 110.189 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.444 HG22 ' HE3' ' A' ' 34' ' ' LYS . 63.0 t -116.44 111.94 41.67 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.201 -0.937 . . . . 0.0 109.698 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.04 140.96 32.15 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 O-C-N 123.123 1.065 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 . . . . . 0 N--CA 1.498 1.944 0 O-C-N 121.178 -0.951 . . . . 0.0 110.138 179.693 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.409 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -143.13 143.64 31.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.168 -1.195 . . . . 0.0 110.227 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.1 ttp -114.85 124.15 51.0 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.208 -0.932 . . . . 0.0 110.25 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.462 ' HB2' HG22 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -138.08 123.09 19.06 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.198 -0.939 . . . . 0.0 110.178 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 19' ' ' LYS . 23.5 mt-10 -120.63 156.41 31.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.092 -1.005 . . . . 0.0 109.818 179.517 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.604 ' O ' HD11 ' A' ' 25' ' ' ILE . 64.8 m95 -100.53 118.63 37.1 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.086 -1.009 . . . . 0.0 110.562 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.473 ' OH ' ' CB ' ' A' ' 34' ' ' LYS . 0.2 OUTLIER -132.58 163.26 29.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.182 -0.949 . . . . 0.0 110.282 178.301 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -58.5 -172.29 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.421 -0.8 . . . . 0.0 109.749 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.511 HG22 ' ND1' ' A' ' 93' ' ' HIS . 41.3 mm -88.12 -50.8 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.097 -1.002 . . . . 0.0 109.118 179.448 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.6 tttp -56.37 -28.33 58.85 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.347 -0.846 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.9 m -65.07 -39.08 92.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 120.856 -1.152 . . . . 0.0 110.251 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.2 tpt -80.31 -40.64 26.4 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.144 -0.973 . . . . 0.0 109.195 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -70.47 -29.29 65.81 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.369 -0.933 . . . . 0.0 109.901 178.526 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -65.96 -38.1 87.71 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.918 -1.114 . . . . 0.0 109.458 179.209 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -58.08 -37.79 75.15 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.116 -0.99 . . . . 0.0 109.938 179.535 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.453 ' N ' HD12 ' A' ' 60' ' ' LEU . 11.0 mp -69.34 -41.56 76.47 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 109.519 179.484 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.756 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.8 mm-40 -68.29 -34.56 76.39 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.267 -0.896 . . . . 0.0 110.234 179.465 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -37.09 33.81 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.065 -1.022 . . . . 0.0 110.284 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.013 -1.054 . . . . 0.0 110.093 179.953 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.8 mtmm . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 120.786 0.327 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.734 HG23 HD11 ' A' ' 76' ' ' LEU . 79.5 mt 52.93 94.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 120.982 -1.074 . . . . 0.0 110.596 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -113.04 133.64 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.193 -0.942 . . . . 0.0 109.837 179.572 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t70 52.7 -163.91 0.08 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.002 -1.061 . . . . 0.0 110.466 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.713 HD22 ' OG1' ' A' ' 91' ' ' THR . 17.0 tp -110.64 -59.5 1.94 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 81.96 0.1 Allowed 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.131 -0.981 . . . . 0.0 109.343 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -166.27 -53.42 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.329 -0.857 . . . . 0.0 110.647 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.777 HD22 ' HB3' ' A' ' 6' ' ' PHE . 94.9 mt -62.38 150.94 38.28 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.262 -0.899 . . . . 0.0 109.462 179.568 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -78.8 118.23 20.66 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.137 -0.977 . . . . 0.0 110.516 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.65 -41.04 0.95 Allowed Glycine 0 N--CA 1.492 2.406 0 C-N-CA 119.646 -1.264 . . . . 0.0 110.942 179.313 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.416 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 30.1 p-90 -57.62 -28.78 63.98 Favored 'General case' 0 N--CA 1.512 2.669 0 CA-C-N 118.838 1.319 . . . . 0.0 111.157 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.1 tp10 -53.66 -27.63 28.6 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.819 -1.176 . . . . 0.0 111.462 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -109.42 24.33 13.24 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.717 -1.239 . . . . 0.0 112.302 -179.342 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.676 HD22 ' HB2' ' A' ' 10' ' ' TYR . 23.8 mt -111.79 -163.33 0.84 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.701 -1.249 . . . . 0.0 109.5 179.283 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -99.64 162.02 13.26 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.93 -1.106 . . . . 0.0 110.47 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.11 -46.98 26.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.263 -0.898 . . . . 0.0 110.08 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -61.52 -46.16 91.14 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.24 -0.913 . . . . 0.0 109.426 179.753 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.452 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 23.1 mt-10 -62.15 -39.91 94.21 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.274 179.095 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.623 ' HA ' HD12 ' A' ' 90' ' ' ILE . 13.6 mtmt -56.0 -37.97 69.84 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.201 -0.937 . . . . 0.0 109.763 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.41 -38.67 74.68 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.224 -0.923 . . . . 0.0 109.879 179.299 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -59.65 -40.73 88.65 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 109.88 179.634 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' A' ' 87' ' ' LYS . 19.2 mt -65.61 -38.29 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 121.317 -0.864 . . . . 0.0 109.399 179.312 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.713 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -60.52 -38.51 84.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.989 -1.069 . . . . 0.0 109.497 179.042 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -56.82 -38.14 72.18 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.224 -0.923 . . . . 0.0 109.873 179.213 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.511 ' ND1' HG22 ' A' ' 53' ' ' ILE . 2.7 m-70 -56.32 -51.39 68.39 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.092 -1.005 . . . . 0.0 109.777 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.412 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.9 mp -62.29 -38.77 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.256 -0.903 . . . . 0.0 109.324 179.524 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.58 -40.95 89.17 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.204 -0.935 . . . . 0.0 109.526 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.19 -41.83 99.25 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.059 179.177 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.756 HD11 ' HG2' ' A' ' 61' ' ' GLU . 2.3 tp -76.26 -35.03 59.14 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.338 -0.851 . . . . 0.0 109.695 178.875 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.4 m -106.44 66.85 0.71 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.053 -1.029 . . . . 0.0 110.041 179.626 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.091 0 O-C-N 121.06 -1.025 . . . . 0.0 110.052 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -115.97 152.47 33.42 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.195 -0.94 . . . . 0.0 110.301 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.535 ' CD1' HD11 ' A' ' 70' ' ' ILE . 0.6 OUTLIER -144.93 135.59 24.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.375 -0.828 . . . . 0.0 109.781 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.487 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.8 m -153.24 165.56 35.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.059 179.227 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.577 HG13 ' HB2' ' A' ' 77' ' ' GLU . 10.2 m -100.75 120.33 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.052 -1.03 . . . . 0.0 110.224 179.451 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.437 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 0.6 OUTLIER -115.15 99.29 7.32 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.102 -0.999 . . . . 0.0 110.099 179.838 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.684 ' CD2' HD13 ' A' ' 82' ' ' LEU . 40.3 m-85 -52.61 156.16 1.97 Allowed 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.144 -0.973 . . . . 0.0 110.427 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.443 ' HB2' ' CG2' ' A' ' 25' ' ' ILE . . . -93.26 112.66 24.65 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.39 -0.819 . . . . 0.0 110.332 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -148.12 38.99 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.309 -0.87 . . . . 0.0 110.416 179.97 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 ttp85 -151.52 39.42 0.65 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.15 -0.969 . . . . 0.0 110.595 -179.942 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.84 -171.43 14.52 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 179.943 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.567 HG23 HG22 ' A' ' 26' ' ' VAL . 61.2 m -117.59 142.85 46.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.251 179.991 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.0 140.0 25.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.998 . . . . 0.0 110.91 -179.968 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.19 140.58 44.81 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 108.614 -1.795 . . . . 0.0 108.614 179.254 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.776 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 21.1 p -80.65 125.32 29.87 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.096 -1.238 . . . . 0.0 111.081 -178.882 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 156.99 38.0 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.839 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.54 16.15 10.37 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.813 -1.18 . . . . 0.0 111.411 -178.68 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.776 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.0 p -176.46 152.37 1.06 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.528 -1.357 . . . . 0.0 110.589 177.997 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 tptm -88.91 91.42 8.82 Favored 'General case' 0 N--CA 1.512 2.663 0 O-C-N 120.969 -1.082 . . . . 0.0 111.598 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.401 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 1.9 tt0 -168.35 -174.41 2.25 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.247 -0.908 . . . . 0.0 110.577 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.5 mttp -128.49 152.76 47.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.001 -1.062 . . . . 0.0 109.709 179.825 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.584 HD13 ' HD3' ' A' ' 31' ' ' ARG . 61.3 mt -107.75 98.85 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.222 -0.924 . . . . 0.0 109.959 -179.982 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.64 ' O ' HG12 ' A' ' 29' ' ' VAL . 60.1 t -105.08 160.58 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.33 -0.856 . . . . 0.0 110.006 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -48.28 134.23 14.87 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 121.442 -0.786 . . . . 0.0 111.085 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.18 6.67 44.87 Favored Glycine 0 N--CA 1.495 2.58 0 C-N-CA 120.176 -1.011 . . . . 0.0 111.496 -179.734 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.64 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.4 p -125.59 137.49 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-N 119.681 1.741 . . . . 0.0 110.45 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 t -92.19 136.35 33.25 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.181 -0.949 . . . . 0.0 110.074 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.584 ' HD3' HD13 ' A' ' 25' ' ' ILE . 5.9 ptt-85 -135.27 149.14 49.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.487 HG23 ' O ' ' A' ' 7' ' ' CYS . 15.6 mt -110.18 126.68 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.181 -0.949 . . . . 0.0 109.784 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.419 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.75 145.16 15.89 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.677 -1.769 . . . . 0.0 108.677 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 28.2 ttpt -111.95 125.08 53.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.192 -1.181 . . . . 0.0 109.057 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.487 HG22 ' HB3' ' A' ' 48' ' ' LYS . 59.7 t -100.26 109.58 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.072 -1.018 . . . . 0.0 110.506 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.59 134.89 24.72 Favored Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.205 -0.934 . . . . 0.0 109.818 179.637 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.24 127.78 11.54 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.107 1.056 . . . . 0.0 110.207 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.1 t30 . . . . . 0 N--CA 1.498 1.97 0 O-C-N 121.146 -0.971 . . . . 0.0 110.186 179.813 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.535 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -116.5 150.52 37.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.258 -1.143 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.3 mtt -111.99 147.39 36.04 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.234 -0.916 . . . . 0.0 110.203 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.487 ' HB3' HG22 ' A' ' 35' ' ' VAL . 5.0 ptpt -143.3 134.61 26.0 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.206 -0.934 . . . . 0.0 110.271 -179.937 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -112.15 159.57 18.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.754 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CZ3' ' HB2' ' A' ' 9' ' ' ASP . 9.1 m95 -110.7 113.77 26.63 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.024 -1.047 . . . . 0.0 111.311 -179.729 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.528 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.4 OUTLIER -126.13 170.07 12.17 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.27 177.205 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 97.0 m-70 -89.21 161.32 16.5 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.836 -0.746 . . . . 0.0 110.463 -179.877 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.483 HG22 ' ND1' ' A' ' 93' ' ' HIS . 27.9 mt -65.53 -47.14 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.078 178.405 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.2 tttt -61.42 -40.73 95.49 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.279 -0.968 . . . . 0.0 109.214 178.609 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.3 m -63.92 -43.71 95.1 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.316 -0.865 . . . . 0.0 109.013 178.952 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.406 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -73.34 -45.58 54.28 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.431 -0.793 . . . . 0.0 109.775 179.938 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.467 ' CE2' HG23 ' A' ' 53' ' ' ILE . 10.6 m-85 -65.48 -28.81 69.47 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.618 179.033 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -64.47 -41.99 96.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.831 -1.168 . . . . 0.0 109.034 178.903 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.1 tptt -72.56 -41.44 65.76 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.375 -0.93 . . . . 0.0 108.702 178.399 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -39.95 94.11 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.529 -0.868 . . . . 0.0 108.857 178.62 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.05 -32.3 66.06 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.128 -0.982 . . . . 0.0 109.663 178.435 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -102.36 28.82 5.61 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.174 -0.954 . . . . 0.0 110.749 179.219 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.877 0 O-C-N 120.794 -1.191 . . . . 0.0 110.356 179.837 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mttp . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 120.804 0.335 . . . . 0.0 110.605 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 6' ' ' PHE . 78.4 mt 54.35 101.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.258 -0.901 . . . . 0.0 111.093 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -112.22 146.65 37.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.319 -0.863 . . . . 0.0 109.014 178.826 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t0 53.81 -161.7 0.12 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.922 -1.111 . . . . 0.0 110.148 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' A' ' 87' ' ' LYS . 4.8 tp -112.54 -60.0 1.93 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.952 -1.092 . . . . 0.0 110.614 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.553 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -72.72 73.36 1.08 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.162 -0.962 . . . . 0.0 109.925 -179.749 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.479 ' CB ' HD23 ' A' ' 76' ' ' LEU . 2.8 mt-10 -129.15 -58.35 1.14 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.19 -0.944 . . . . 0.0 110.309 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.647 HD23 ' N ' ' A' ' 76' ' ' LEU . 1.3 pt? -147.87 63.83 1.12 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.968 -1.083 . . . . 0.0 110.796 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.577 ' HB2' HG13 ' A' ' 8' ' ' VAL . 8.7 pt-20 -144.42 140.2 28.85 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.01 -1.056 . . . . 0.0 110.266 178.299 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.611 ' O ' HD12 ' A' ' 82' ' ' LEU . . . -72.59 69.01 1.2 Allowed Glycine 0 N--CA 1.498 2.814 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.763 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.553 ' CE2' HG22 ' A' ' 74' ' ' THR . 59.5 p-90 -92.49 -36.25 13.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.118 -1.224 . . . . 0.0 110.805 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -53.17 -28.92 28.86 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.057 -1.027 . . . . 0.0 111.363 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -96.38 -34.88 11.38 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.889 -1.132 . . . . 0.0 111.18 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.684 HD13 ' CD2' ' A' ' 10' ' ' TYR . 61.3 mt -74.7 -173.8 1.94 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.956 -1.09 . . . . 0.0 110.256 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.3 152.67 33.06 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.193 -0.942 . . . . 0.0 110.71 -179.399 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -89.78 -39.2 13.27 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.237 -0.914 . . . . 0.0 110.437 179.661 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.89 -44.25 86.59 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.046 -1.033 . . . . 0.0 109.971 -179.882 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.454 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.3 mt-10 -60.52 -39.81 89.17 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.444 179.175 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.75 ' HG2' HD21 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -55.78 -38.19 69.57 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.904 179.182 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -41.66 90.15 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.865 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.45 -32.7 72.69 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.267 -0.896 . . . . 0.0 110.656 179.858 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.61 ' HB ' HD11 ' A' ' 73' ' ' LEU . 97.2 mt -65.12 -39.0 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 120.979 -1.076 . . . . 0.0 109.675 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.639 ' OG1' HD22 ' A' ' 73' ' ' LEU . 41.6 m -59.01 -39.09 80.82 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.964 -1.085 . . . . 0.0 109.892 179.649 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -56.32 -37.28 69.72 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.203 -0.936 . . . . 0.0 109.975 179.374 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.483 ' ND1' HG22 ' A' ' 53' ' ' ILE . 2.5 m-70 -57.46 -51.96 67.32 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.01 . . . . 0.0 110.008 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.3 mp -64.24 -38.62 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.31 179.642 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.66 81.43 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.203 -0.935 . . . . 0.0 109.741 179.118 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -66.57 -39.55 88.52 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.179 -0.951 . . . . 0.0 109.873 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -74.31 -34.73 63.57 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.281 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 74.8 m -96.53 58.09 1.69 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.027 -1.045 . . . . 0.0 110.094 179.762 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 90.9 p . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.131 -0.981 . . . . 0.0 110.253 179.934 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.717 ' N ' HE21 ' A' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.712 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.99 151.51 36.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.25 -0.906 . . . . 0.0 110.215 -179.943 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.731 ' O ' HD12 ' A' ' 76' ' ' LEU . 1.1 m-85 -149.27 136.45 19.93 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.304 -0.873 . . . . 0.0 110.205 -179.65 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' ILE . 26.2 p -151.93 157.66 42.1 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.227 -0.921 . . . . 0.0 109.807 178.735 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.753 HG22 ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -102.3 141.44 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.834 -1.166 . . . . 0.0 110.798 179.869 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -141.97 148.24 38.27 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.269 -0.894 . . . . 0.0 109.607 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.443 ' CD2' HD11 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -96.02 151.61 19.29 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.085 -1.01 . . . . 0.0 109.873 179.917 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HB2' ' HD2' ' A' ' 31' ' ' ARG . . . -92.95 147.14 23.09 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.289 -0.882 . . . . 0.0 110.546 -179.578 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -120.1 -57.83 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.29 -0.881 . . . . 0.0 110.056 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -139.29 132.54 29.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.184 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.15 164.67 14.49 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 179.898 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.9 m -135.0 143.71 46.97 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -1.159 . . . . 0.0 110.258 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.32 143.82 34.26 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.222 -0.924 . . . . 0.0 110.884 -179.85 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.05 127.87 13.46 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.09 130.39 44.45 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.358 -1.084 . . . . 0.0 109.381 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.443 ' HB3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -61.92 147.86 45.45 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 109.212 179.793 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 mttt 52.6 45.41 28.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.905 -1.122 . . . . 0.0 109.591 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 31.6 t -164.89 144.72 7.14 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.386 -0.821 . . . . 0.0 110.769 -178.156 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.75 56.71 1.29 Allowed 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -145.63 -172.05 3.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.374 -0.829 . . . . 0.0 110.238 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -135.31 159.29 42.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.193 -0.942 . . . . 0.0 109.629 -179.6 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.684 HG21 ' HG2' ' A' ' 31' ' ' ARG . 74.3 mt -107.92 119.36 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.41 -0.806 . . . . 0.0 110.057 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.686 ' O ' HG12 ' A' ' 29' ' ' VAL . 32.4 m -118.7 166.2 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.202 -0.936 . . . . 0.0 110.584 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -48.13 143.28 4.57 Favored 'General case' 0 N--CA 1.515 2.784 0 O-C-N 121.512 -0.742 . . . . 0.0 111.023 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 96.3 5.83 59.07 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.15 -1.024 . . . . 0.0 111.239 -179.362 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 26' ' ' VAL . 7.1 p -126.89 133.63 68.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 119.545 1.673 . . . . 0.0 109.977 179.796 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.657 ' HB3' HD11 ' A' ' 53' ' ' ILE . 43.2 t -81.13 139.31 35.69 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.052 -1.03 . . . . 0.0 109.341 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.74 ' HD2' ' HB2' ' A' ' 11' ' ' ALA . 7.8 mtp180 -124.21 142.9 50.85 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.176 -0.952 . . . . 0.0 110.697 -178.731 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.548 HD12 ' HG2' ' A' ' 56' ' ' MET . 22.9 mt -96.74 129.01 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.105 -0.997 . . . . 0.0 109.375 178.722 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.9 122.72 7.7 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 58.4 tttt -106.25 122.07 45.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.217 -1.166 . . . . 0.0 109.703 -179.79 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -101.0 115.54 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.996 . . . . 0.0 110.361 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.2 t -120.73 111.67 34.33 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.214 -0.929 . . . . 0.0 109.762 179.826 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.08 131.01 14.91 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.131 1.069 . . . . 0.0 110.431 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.231 -0.918 . . . . 0.0 110.035 179.734 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.419 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -133.47 151.17 51.75 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.216 -1.167 . . . . 0.0 110.466 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttt -110.91 142.8 42.49 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.337 -0.852 . . . . 0.0 110.019 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -119.6 124.84 47.34 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.166 -0.959 . . . . 0.0 110.328 -179.769 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -112.15 146.88 37.26 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.142 -0.974 . . . . 0.0 109.627 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 18.0 m95 -98.88 128.17 44.99 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.181 -0.95 . . . . 0.0 110.281 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.443 ' CE2' ' HB3' ' A' ' 19' ' ' LYS . 86.9 m-85 -111.56 172.8 6.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -90.25 -173.09 3.7 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.534 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.891 HG22 ' CE1' ' A' ' 93' ' ' HIS . 40.5 mm -87.28 -38.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.005 -1.06 . . . . 0.0 109.332 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -88.13 -29.33 20.66 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.73 -1.231 . . . . 0.0 110.915 179.116 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.6 m -65.9 -51.66 56.71 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.835 -1.166 . . . . 0.0 110.487 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' MET . . . . . 0.548 ' HG2' HD12 ' A' ' 32' ' ' ILE . 10.6 tpt -66.59 -39.75 88.56 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.178 -179.509 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.458 ' HD1' HD22 ' A' ' 97' ' ' LEU . 6.7 m-85 -72.87 -30.56 64.08 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.792 179.191 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -67.75 -36.71 81.03 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.918 -1.114 . . . . 0.0 109.639 178.784 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -39.87 86.73 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.045 -1.034 . . . . 0.0 109.82 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -59.08 -43.39 91.8 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.248 179.351 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.5 ' HG3' HD11 ' A' ' 97' ' ' LEU . 3.8 mt-10 -57.82 -34.67 69.92 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.194 -0.941 . . . . 0.0 109.484 178.497 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 6.9 ttm105 -103.78 30.77 4.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.399 179.037 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.024 0 O-C-N 120.917 -1.115 . . . . 0.0 109.945 179.643 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 120.733 0.302 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.9 mt 54.28 99.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.163 -0.961 . . . . 0.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -112.79 134.86 54.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.209 -0.932 . . . . 0.0 109.647 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 t70 53.74 -165.18 0.09 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.964 -1.085 . . . . 0.0 110.451 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.848 HD13 HG22 ' A' ' 91' ' ' THR . 0.3 OUTLIER -114.26 -176.97 3.02 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.103 -0.998 . . . . 0.0 110.218 179.913 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.593 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.5 OUTLIER 46.73 37.3 4.54 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.154 -0.966 . . . . 0.0 111.425 -179.777 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.512 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.9 mm-40 -111.45 -60.05 1.9 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.599 179.547 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.731 HD12 ' O ' ' A' ' 6' ' ' PHE . 1.1 pt? -143.42 62.3 1.38 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.214 -0.929 . . . . 0.0 109.772 178.681 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.753 ' HB2' HG22 ' A' ' 8' ' ' VAL . 12.8 pt-20 -144.92 141.26 28.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.754 -1.216 . . . . 0.0 111.002 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.02 70.12 1.24 Allowed Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.806 -1.718 . . . . 0.0 108.806 178.859 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.593 ' CE2' HG22 ' A' ' 74' ' ' THR . 60.7 p-90 -90.7 -23.55 20.69 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.313 -1.11 . . . . 0.0 111.787 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -51.77 -32.0 29.15 Favored 'General case' 0 N--CA 1.514 2.756 0 O-C-N 120.702 -1.248 . . . . 0.0 110.768 179.741 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -83.48 -38.6 21.61 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.917 -1.115 . . . . 0.0 109.892 179.243 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.443 HD11 ' CD2' ' A' ' 10' ' ' TYR . 0.2 OUTLIER -51.76 178.63 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.84 0 O-C-N 121.062 -1.024 . . . . 0.0 110.508 -179.925 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -105.68 160.85 14.89 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.127 -0.983 . . . . 0.0 110.415 179.872 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -58.72 -39.79 81.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.272 -0.892 . . . . 0.0 110.403 -179.646 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -66.38 -42.41 87.99 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.249 -0.907 . . . . 0.0 109.705 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.413 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 20.3 mt-10 -66.63 -39.29 88.24 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.513 -0.875 . . . . 0.0 109.416 179.234 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.724 ' HA ' HD12 ' A' ' 90' ' ' ILE . 16.2 ttpp -61.38 -39.08 89.35 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.843 179.334 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 13.6 tt0 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.165 -0.96 . . . . 0.0 110.063 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -63.8 -39.29 93.89 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.151 -0.968 . . . . 0.0 110.083 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.724 HD12 ' HA ' ' A' ' 87' ' ' LYS . 8.3 mt -67.17 -41.15 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.417 0 O-C-N 121.216 -0.928 . . . . 0.0 109.379 179.495 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 91' ' ' THR . . . . . 0.848 HG22 HD13 ' A' ' 73' ' ' LEU . 30.5 p -60.83 -38.32 85.08 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.166 -0.959 . . . . 0.0 109.802 179.437 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -57.6 -39.89 77.84 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.113 -0.992 . . . . 0.0 109.845 179.533 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.891 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.8 m-70 -60.2 -52.99 62.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.19 -0.943 . . . . 0.0 109.702 179.651 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.603 ' CD1' HD12 ' A' ' 73' ' ' LEU . 7.9 mt -63.28 -39.21 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 C-N-CA 119.352 -0.939 . . . . 0.0 109.414 179.46 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.02 -41.14 91.37 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.179 -0.95 . . . . 0.0 109.219 178.997 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -71.07 -42.6 69.19 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.201 -0.937 . . . . 0.0 108.703 178.731 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.5 HD11 ' HG3' ' A' ' 61' ' ' GLU . 2.5 tp -62.53 -34.11 76.25 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.323 -0.861 . . . . 0.0 109.974 178.94 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.4 t -96.92 52.66 1.18 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.115 -0.991 . . . . 0.0 110.165 179.754 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 N--CA 1.493 1.704 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.911 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.441 ' CB ' HG22 ' A' ' 36' ' ' VAL . 39.8 mt-30 . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.7 156.67 37.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.179 -0.95 . . . . 0.0 110.395 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.511 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -147.34 136.63 22.54 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.423 -0.798 . . . . 0.0 109.915 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.497 ' O ' HG23 ' A' ' 32' ' ' ILE . 26.3 p -152.83 160.93 43.11 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 110.027 178.957 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.67 HG22 ' HB2' ' A' ' 77' ' ' GLU . 6.8 m -101.98 122.57 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 120.926 -1.109 . . . . 0.0 110.612 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.71 154.99 34.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.103 -0.998 . . . . 0.0 110.223 179.58 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.53 149.48 27.09 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.487 -0.758 . . . . 0.0 110.075 -179.798 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.484 ' HB2' HH11 ' A' ' 31' ' ' ARG . . . -111.16 126.29 54.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.244 -0.91 . . . . 0.0 110.127 179.8 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -116.61 -56.18 2.3 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.262 -0.899 . . . . 0.0 110.277 -179.916 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -117.39 93.18 4.07 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.156 -0.965 . . . . 0.0 110.307 -179.966 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.44 126.74 2.29 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.846 HG22 ' HA ' ' A' ' 26' ' ' VAL . 77.2 p -115.58 145.59 42.53 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.202 -1.175 . . . . 0.0 110.07 179.881 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.92 145.54 28.66 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.195 -0.941 . . . . 0.0 110.879 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.34 130.44 47.7 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.915 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 31.1 p -69.6 117.13 10.82 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.28 -1.129 . . . . 0.0 111.014 -178.722 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 11.8 mmtt -64.59 157.28 27.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.15 -0.969 . . . . 0.0 109.547 179.849 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.52 18.42 11.05 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.519 -1.363 . . . . 0.0 111.395 -178.909 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.915 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 10.2 p -175.18 143.65 0.69 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.576 -1.328 . . . . 0.0 110.663 178.13 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.87 84.69 7.3 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.017 -1.052 . . . . 0.0 111.914 -177.861 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.403 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 1.3 tt0 -163.6 -174.71 3.83 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 178.687 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.4 ttmm -129.69 156.57 44.04 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.002 -1.061 . . . . 0.0 109.983 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.632 HG23 ' CG1' ' A' ' 29' ' ' VAL . 75.4 mt -109.14 129.53 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.846 ' HA ' HG22 ' A' ' 15' ' ' THR . 33.3 m -125.17 160.39 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.174 -0.954 . . . . 0.0 110.238 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -46.29 134.67 8.62 Favored 'General case' 0 N--CA 1.518 2.931 0 O-C-N 121.43 -0.794 . . . . 0.0 111.452 -179.321 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.43 10.39 44.66 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.386 -179.623 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.632 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.8 p -125.53 135.9 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 CA-C-N 119.667 1.733 . . . . 0.0 110.424 -179.85 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 45.1 t -92.24 130.28 37.98 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.192 -0.943 . . . . 0.0 109.511 179.26 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.515 ' HD2' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -125.26 150.85 46.67 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.233 -0.917 . . . . 0.0 110.538 -179.693 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.497 HG23 ' O ' ' A' ' 7' ' ' CYS . 22.1 mt -101.65 129.12 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.275 -0.891 . . . . 0.0 109.644 179.747 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.438 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.63 129.67 9.93 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.258 -1.537 . . . . 0.0 109.258 179.967 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 11.4 ttpt -101.85 121.26 41.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.302 -1.116 . . . . 0.0 109.066 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.504 HG22 ' HG3' ' A' ' 48' ' ' LYS . 56.0 t -102.71 110.51 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.022 -1.049 . . . . 0.0 110.552 -179.446 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.441 HG22 ' CB ' ' A' ' 4' ' ' GLN . 57.5 t -121.32 112.09 33.15 Favored Pre-proline 0 N--CA 1.496 1.855 0 O-C-N 121.265 -0.897 . . . . 0.0 109.568 179.612 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.26 126.49 11.11 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.116 1.061 . . . . 0.0 110.451 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.3 m120 . . . . . 0 N--CA 1.499 1.982 0 O-C-N 121.252 -0.905 . . . . 0.0 110.183 179.671 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.543 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.489 ' OD1' HG12 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -114.51 148.4 37.96 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.21 -1.171 . . . . 0.0 110.105 -179.94 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.9 mtt -114.99 119.78 37.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.293 -0.879 . . . . 0.0 110.274 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HG3' HG22 ' A' ' 35' ' ' VAL . 26.3 ttmt -116.1 127.96 55.28 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.208 -0.932 . . . . 0.0 109.988 179.829 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -114.59 124.99 53.24 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.438 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 17.6 m95 -89.01 126.69 35.53 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.187 -0.946 . . . . 0.0 110.057 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.511 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 1.0 OUTLIER -147.21 170.46 17.2 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.527 178.68 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -74.72 179.69 4.64 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.658 -0.651 . . . . 0.0 111.217 -178.414 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.522 HG22 ' ND1' ' A' ' 93' ' ' HIS . 33.6 mm -88.57 -48.92 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 179.044 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -60.46 -38.6 84.71 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.342 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.1 m -61.69 -50.01 74.21 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.238 -0.914 . . . . 0.0 109.068 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.4 tpt -68.91 -45.49 70.76 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.729 -0.789 . . . . 0.0 109.385 179.577 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -63.95 -30.47 71.55 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.615 178.926 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -60.43 -39.79 88.74 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.883 -1.136 . . . . 0.0 109.62 179.143 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.408 179.251 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -59.83 -42.61 93.91 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.126 -0.984 . . . . 0.0 109.173 179.23 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -58.51 -34.49 71.01 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.229 -0.92 . . . . 0.0 109.661 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -105.42 30.19 5.88 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.208 -0.932 . . . . 0.0 110.723 179.261 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 110.104 179.854 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.07 98.25 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.232 -0.917 . . . . 0.0 110.689 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -109.51 134.63 51.66 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.228 -0.92 . . . . 0.0 109.544 179.339 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.405 ' HA ' HG21 ' A' ' 94' ' ' ILE . 0.2 OUTLIER 54.37 -165.36 0.1 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.956 -1.09 . . . . 0.0 110.203 -179.534 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.81 HD11 HG22 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -116.16 -172.41 2.17 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.122 -0.986 . . . . 0.0 110.201 179.872 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.627 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.7 OUTLIER 46.9 37.1 4.51 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.114 -0.992 . . . . 0.0 111.296 -179.577 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.783 ' HB3' HD23 ' A' ' 76' ' ' LEU . 10.4 tt0 -109.81 -58.3 2.07 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.153 -0.967 . . . . 0.0 109.652 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.783 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.2 pt? -145.23 62.2 1.29 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.093 -1.004 . . . . 0.0 109.861 178.668 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.67 ' HB2' HG22 ' A' ' 8' ' ' VAL . 12.4 pt-20 -143.92 140.82 29.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.8 -1.188 . . . . 0.0 110.867 179.321 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.77 70.27 0.95 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.627 ' CE2' HG22 ' A' ' 74' ' ' THR . 61.8 p-90 -90.58 -23.4 20.86 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.23 -1.159 . . . . 0.0 111.644 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -52.47 -34.41 48.94 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.685 -1.259 . . . . 0.0 110.285 179.45 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.68 -39.03 20.71 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.088 -1.007 . . . . 0.0 109.635 178.972 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.12 177.21 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.046 -1.034 . . . . 0.0 110.42 179.787 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -101.31 160.56 14.31 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.137 -0.977 . . . . 0.0 110.413 179.855 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.7 -42.9 98.12 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.26 -0.9 . . . . 0.0 110.101 -179.888 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.69 -41.8 99.3 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.539 -0.865 . . . . 0.0 109.751 179.839 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.402 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 71.4 mt-10 -67.52 -40.56 85.1 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.523 -0.871 . . . . 0.0 109.253 179.109 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -61.3 -38.91 88.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.305 -0.872 . . . . 0.0 109.814 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -58.77 -39.75 81.93 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.258 -0.901 . . . . 0.0 109.922 179.743 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -60.52 -35.73 76.68 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.152 -0.967 . . . . 0.0 110.362 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.81 HG22 HD11 ' A' ' 73' ' ' LEU . 47.7 mm -69.28 -39.2 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.084 -1.01 . . . . 0.0 109.371 179.561 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 73.5 p -61.31 -39.18 89.52 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.023 -1.048 . . . . 0.0 109.603 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -57.61 -36.85 72.32 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.153 -0.967 . . . . 0.0 109.906 179.226 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.522 ' ND1' HG22 ' A' ' 53' ' ' ILE . 12.7 m-70 -59.37 -53.43 58.29 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.127 -0.983 . . . . 0.0 109.878 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.468 ' CD1' HD12 ' A' ' 73' ' ' LEU . 2.4 mp -63.29 -38.55 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.435 179.616 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.24 77.42 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.182 -0.949 . . . . 0.0 109.9 179.198 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.73 -38.4 73.56 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.13 -0.981 . . . . 0.0 109.712 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -78.9 -32.75 45.91 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.116 -0.99 . . . . 0.0 110.315 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.8 t -96.01 54.03 1.43 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.98 -1.075 . . . . 0.0 110.193 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.494 1.767 0 O-C-N 121.126 -0.984 . . . . 0.0 110.227 179.859 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 . . . . . 0 N--CA 1.494 1.746 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.22 145.04 51.05 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.948 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.522 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -150.24 137.6 19.66 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.286 -0.884 . . . . 0.0 109.726 -179.94 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.46 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.7 m -153.3 157.03 39.5 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.157 -0.964 . . . . 0.0 110.258 179.193 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 77' ' ' GLU . 5.7 m -100.98 135.09 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.308 0 O-C-N 121.004 -1.06 . . . . 0.0 110.505 179.637 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.52 157.71 46.21 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.335 -0.853 . . . . 0.0 110.133 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.441 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -107.17 154.91 20.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.407 -0.808 . . . . 0.0 110.085 -179.958 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.97 133.07 37.79 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.319 -0.863 . . . . 0.0 110.061 179.76 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 -55.44 2.44 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.27 -0.894 . . . . 0.0 110.456 -179.805 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 -138.51 105.87 5.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.166 -0.959 . . . . 0.0 110.29 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.75 151.56 6.04 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.421 HG23 HG12 ' A' ' 26' ' ' VAL . 83.8 m -116.11 142.23 47.09 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.226 -1.161 . . . . 0.0 110.033 179.897 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.23 129.74 27.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.141 -0.974 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.77 122.19 25.56 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -61.24 129.91 43.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -1.151 . . . . 0.0 109.441 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.441 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 14.9 tptt -61.98 147.42 47.05 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.168 179.827 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt 52.29 48.45 22.63 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.05 -1.031 . . . . 0.0 109.776 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.5 t -164.43 155.75 15.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.342 -0.849 . . . . 0.0 110.736 -178.147 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.87 44.25 1.04 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.27 -0.894 . . . . 0.0 108.604 178.629 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.35 -174.65 4.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.447 -0.783 . . . . 0.0 110.198 -179.045 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -136.46 156.62 48.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.091 -1.006 . . . . 0.0 109.743 -179.516 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.687 HG23 ' CG1' ' A' ' 29' ' ' VAL . 49.4 mt -97.58 121.56 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.645 179.875 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.421 HG12 HG23 ' A' ' 15' ' ' THR . 34.1 m -129.51 176.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.331 -0.855 . . . . 0.0 110.6 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -43.64 125.88 4.26 Favored 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.784 -0.573 . . . . 0.0 111.334 -179.544 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.16 8.58 50.2 Favored Glycine 0 N--CA 1.492 2.417 0 C-N-CA 120.151 -1.023 . . . . 0.0 110.955 -179.212 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.687 ' CG1' HG23 ' A' ' 25' ' ' ILE . 54.9 t -122.07 134.45 65.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-N 119.562 1.681 . . . . 0.0 109.869 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.701 ' HB3' HD11 ' A' ' 53' ' ' ILE . 51.4 t -96.36 138.03 34.56 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.25 -0.906 . . . . 0.0 108.64 178.516 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.525 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.9 ptt85 -136.05 151.05 49.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.128 -0.982 . . . . 0.0 111.151 -178.924 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.46 HG23 ' O ' ' A' ' 7' ' ' CYS . 20.5 mt -105.01 137.0 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.26 -0.9 . . . . 0.0 109.832 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.13 127.16 8.7 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 108.934 -1.666 . . . . 0.0 108.934 179.658 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB3' ' CE1' ' A' ' 6' ' ' PHE . 49.6 pttt -110.89 124.05 51.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.154 -1.203 . . . . 0.0 110.08 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -112.72 107.99 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.918 -1.114 . . . . 0.0 110.121 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -122.39 112.23 31.38 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.225 -0.922 . . . . 0.0 109.919 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.74 127.19 12.08 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.198 1.104 . . . . 0.0 110.206 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 . . . . . 0 N--CA 1.499 1.982 0 O-C-N 121.112 -0.992 . . . . 0.0 110.162 179.75 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.467 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.49 133.88 55.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.148 -1.207 . . . . 0.0 110.256 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 37.5 mtt -117.52 138.49 51.86 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.169 -0.957 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 ttmm -117.23 125.77 51.69 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.187 -0.945 . . . . 0.0 109.996 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -114.81 134.6 54.99 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.181 -0.95 . . . . 0.0 109.946 179.91 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 42.2 m95 -93.09 126.93 38.43 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.31 -0.869 . . . . 0.0 109.655 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.448 ' OH ' ' CE ' ' A' ' 34' ' ' LYS . 98.1 m-85 -112.2 174.66 5.77 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.289 -0.882 . . . . 0.0 110.616 -179.477 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.401 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 1.1 m170 -92.64 -172.35 3.02 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.842 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.93 HG22 ' CE1' ' A' ' 93' ' ' HIS . 35.2 mm -83.74 -41.62 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.928 178.828 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -89.13 -24.29 22.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.01 -1.056 . . . . 0.0 111.384 179.164 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 60.8 m -75.8 -41.44 52.81 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.638 -1.289 . . . . 0.0 110.198 -179.946 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -36.24 67.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.399 -0.92 . . . . 0.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.446 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 11.2 m-85 -80.89 -31.69 35.13 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 119.024 -1.07 . . . . 0.0 109.737 179.089 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -78.79 -33.42 46.28 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.032 -1.042 . . . . 0.0 109.677 178.153 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -72.95 -33.39 65.88 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.028 -1.045 . . . . 0.0 109.979 179.224 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 tp -75.24 -40.15 59.25 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.033 -1.042 . . . . 0.0 109.443 179.291 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -73.5 -30.28 63.03 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.219 -0.925 . . . . 0.0 110.324 178.925 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.75 -30.47 14.24 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.036 -1.04 . . . . 0.0 111.003 179.918 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 59' ' ' LYS . . . . . . . . 0 N--CA 1.494 1.761 0 O-C-N 120.907 -1.121 . . . . 0.0 110.429 -179.567 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.5 tptm . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.679 0.276 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.5 mt -112.51 113.83 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.292 -0.88 . . . . 0.0 109.66 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.414 ' HA ' ' CG2' ' A' ' 94' ' ' ILE . 12.7 mt-10 -110.48 155.04 22.79 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.185 -0.947 . . . . 0.0 110.391 -179.777 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.563 ' N ' HG21 ' A' ' 94' ' ' ILE . 0.8 OUTLIER 50.95 -175.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.06 -1.025 . . . . 0.0 110.897 -179.983 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.673 HD23 ' HG3' ' A' ' 87' ' ' LYS . 15.2 tp -125.61 37.92 4.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.281 -0.887 . . . . 0.0 110.575 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.614 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.6 OUTLIER -145.64 39.19 1.15 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.189 -0.945 . . . . 0.0 110.306 179.661 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.504 ' HB2' HD23 ' A' ' 76' ' ' LEU . 13.9 mt-10 -109.75 -58.61 2.03 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.204 -0.935 . . . . 0.0 109.581 179.452 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.631 HD23 ' N ' ' A' ' 76' ' ' LEU . 1.3 pt? -145.28 62.69 1.29 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.235 -0.916 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.726 ' HB2' HG22 ' A' ' 8' ' ' VAL . 0.7 OUTLIER -145.86 141.0 27.45 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.902 -1.124 . . . . 0.0 111.062 179.394 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.89 69.24 2.45 Favored Glycine 0 N--CA 1.496 2.675 0 N-CA-C 108.943 -1.663 . . . . 0.0 108.943 179.227 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.614 ' CE2' HG22 ' A' ' 74' ' ' THR . 61.7 p-90 -89.08 -23.49 22.51 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.248 -1.148 . . . . 0.0 111.783 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -52.12 -33.55 40.41 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.581 -1.324 . . . . 0.0 110.692 179.829 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.73 -38.43 28.77 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.953 -1.092 . . . . 0.0 109.817 179.173 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.403 ' CD2' ' CD1' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -50.88 177.58 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.139 -0.976 . . . . 0.0 110.686 -179.991 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -102.75 160.45 14.58 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.122 -0.986 . . . . 0.0 110.355 179.823 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -60.94 -43.5 98.6 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.259 -0.9 . . . . 0.0 110.177 -179.819 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -61.27 -50.57 72.49 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.27 -0.893 . . . . 0.0 109.56 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 1.2 mp0 -62.92 -41.04 99.34 Favored 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.157 178.975 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.673 ' HG3' HD23 ' A' ' 73' ' ' LEU . 1.3 ttpm? -60.09 -38.46 82.98 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.35 -0.844 . . . . 0.0 110.005 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.84 -39.14 93.09 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.227 -0.92 . . . . 0.0 110.065 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -39.82 87.69 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.103 -0.998 . . . . 0.0 110.006 179.791 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 87' ' ' LYS . 13.6 mt -66.13 -39.73 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.197 -0.939 . . . . 0.0 109.395 179.45 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.49 -37.9 79.46 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.171 -0.956 . . . . 0.0 109.955 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -58.29 -39.86 80.41 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.194 -0.942 . . . . 0.0 109.814 179.454 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.93 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.84 -50.83 72.52 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.178 -0.951 . . . . 0.0 110.076 179.813 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 94' ' ' ILE . . . . . 0.563 HG21 ' N ' ' A' ' 72' ' ' ASP . 4.1 mt -58.88 -38.4 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.18 -0.95 . . . . 0.0 110.015 179.851 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.65 -38.89 86.32 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.164 -0.96 . . . . 0.0 109.681 179.276 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -59.81 -46.2 89.98 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.168 -0.958 . . . . 0.0 109.596 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.4 mp -57.21 -34.26 68.36 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.116 -0.99 . . . . 0.0 110.381 179.589 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.2 m -97.93 51.41 1.04 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.03 -1.044 . . . . 0.0 110.095 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.945 . . . . 0.0 110.1 179.926 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -117.51 146.84 43.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.138 -0.976 . . . . 0.0 110.329 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.668 ' CD1' HD11 ' A' ' 70' ' ' ILE . 0.7 OUTLIER -140.28 136.82 33.68 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.317 -0.864 . . . . 0.0 109.88 -179.882 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.512 ' O ' HG23 ' A' ' 32' ' ' ILE . 4.1 m -151.74 160.85 43.44 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.198 -0.939 . . . . 0.0 110.056 178.942 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -101.41 120.9 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.996 -1.065 . . . . 0.0 110.638 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -114.24 146.85 39.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.207 -0.933 . . . . 0.0 109.445 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.575 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.2 OUTLIER -100.22 147.16 26.03 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.854 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.484 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -83.99 128.18 34.37 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.008 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -151.77 38.02 0.59 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.176 -0.952 . . . . 0.0 110.77 179.953 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.58 50.82 0.18 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.183 -0.948 . . . . 0.0 110.887 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.41 -147.88 16.92 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -133.42 149.17 51.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.27 -1.136 . . . . 0.0 110.333 -179.948 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.4 132.09 45.6 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.206 -0.934 . . . . 0.0 110.678 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.73 121.9 28.17 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 179.835 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' CYS . . . . . 0.458 ' HG ' ' HG ' ' A' ' 21' ' ' CYS . 34.8 t -62.78 137.54 58.29 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.324 -1.103 . . . . 0.0 110.298 -179.334 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -88.48 152.84 21.61 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 177.596 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.71 33.18 18.11 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.862 -1.149 . . . . 0.0 109.824 -178.413 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.458 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER 179.59 150.78 0.35 Allowed 'General case' 0 N--CA 1.517 2.893 0 O-C-N 120.827 -1.17 . . . . 0.0 109.373 179.77 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -93.96 67.58 3.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.155 -0.965 . . . . 0.0 109.773 179.793 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -149.86 -176.27 5.36 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.256 -0.902 . . . . 0.0 110.403 -179.366 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -132.67 150.9 52.09 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.952 -1.092 . . . . 0.0 109.881 -179.236 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.704 HG23 ' CG2' ' A' ' 29' ' ' VAL . 13.4 mt -104.21 98.29 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.361 -0.837 . . . . 0.0 109.167 179.517 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 49.0 t -85.19 157.61 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 O-C-N 121.305 -0.872 . . . . 0.0 110.514 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -51.3 123.56 9.88 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.261 -0.899 . . . . 0.0 110.725 -179.605 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.19 -18.15 10.38 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 119.937 -1.125 . . . . 0.0 111.363 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.704 ' CG2' HG23 ' A' ' 25' ' ' ILE . 4.4 m -98.9 135.02 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 CA-C-N 119.584 1.692 . . . . 0.0 110.367 -179.51 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.4 p -79.55 131.65 36.08 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.934 179.851 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.518 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.4 ptt-85 -132.81 149.71 52.24 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.278 -0.889 . . . . 0.0 110.091 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.512 HG23 ' O ' ' A' ' 7' ' ' CYS . 17.5 mt -106.25 130.8 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.151 -0.968 . . . . 0.0 109.841 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.435 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.46 138.43 14.25 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.406 -1.878 . . . . 0.0 108.406 179.225 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 9.0 ttpt -107.15 108.96 20.67 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.184 -1.186 . . . . 0.0 109.469 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.447 HG12 ' OD1' ' A' ' 46' ' ' ASP . 52.7 t -85.83 119.64 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.054 -1.029 . . . . 0.0 110.383 -179.755 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.425 HG21 ' HE3' ' A' ' 34' ' ' LYS . 60.9 t -121.41 112.04 33.04 Favored Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.24 -0.912 . . . . 0.0 109.873 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.84 134.33 21.59 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 O-C-N 123.141 1.074 . . . . 0.0 110.544 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 N--CA 1.499 1.994 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 179.698 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.633 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.447 ' OD1' HG12 ' A' ' 35' ' ' VAL . 1.2 t0 -114.94 133.23 56.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -1.165 . . . . 0.0 109.922 179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.6 mmt -117.3 144.41 44.9 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.182 -0.949 . . . . 0.0 110.523 -179.808 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -139.84 139.0 36.22 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.357 -0.839 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -111.04 130.91 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.192 -0.942 . . . . 0.0 109.6 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.559 ' O ' HD11 ' A' ' 25' ' ' ILE . 7.8 m95 -89.91 113.54 25.18 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.19 -0.944 . . . . 0.0 109.627 179.768 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.47 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -137.5 168.3 19.93 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.787 -1.165 . . . . 0.0 111.4 178.977 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 60.4 m80 -71.89 158.15 36.56 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.57 -0.706 . . . . 0.0 109.769 -179.151 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.492 HG22 ' CD2' ' A' ' 93' ' ' HIS . 51.1 mt -61.67 -44.58 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.264 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -31.4 65.57 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.253 -0.905 . . . . 0.0 110.552 179.461 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.4 m -70.76 -41.08 72.22 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.024 -1.048 . . . . 0.0 109.749 179.852 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.9 tpt -76.31 -40.58 51.14 Favored 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.964 178.765 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CD1' ' CG2' ' A' ' 53' ' ' ILE . 7.5 m-85 -64.68 -33.27 75.56 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.543 178.507 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -58.15 -39.6 79.22 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.986 -1.071 . . . . 0.0 109.833 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.5 tttp -63.61 -40.08 95.99 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.585 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.95 -42.67 85.45 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.095 -1.003 . . . . 0.0 109.251 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.0 -35.46 73.28 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.234 -0.916 . . . . 0.0 109.327 178.501 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -105.78 31.53 4.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.838 0 O-C-N 120.902 -1.124 . . . . 0.0 110.013 179.958 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 120.97 0.414 . . . . 0.0 110.803 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.709 ' HA ' HD21 ' A' ' 76' ' ' LEU . 77.9 mt 52.87 99.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.187 -0.946 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.2 139.6 48.64 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 108.865 178.688 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 55.42 -163.74 0.14 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.948 -1.095 . . . . 0.0 109.712 -179.249 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.552 ' C ' HD23 ' A' ' 73' ' ' LEU . 10.6 tt -106.49 -51.13 3.0 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.925 -1.109 . . . . 0.0 110.685 -179.845 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.402 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -80.73 77.43 7.58 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.097 -1.002 . . . . 0.0 110.167 -179.829 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.757 ' HB3' HD23 ' A' ' 76' ' ' LEU . 29.2 tt0 -138.65 -58.61 0.62 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.131 -0.98 . . . . 0.0 110.499 179.749 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.757 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.5 pt? -147.62 60.05 1.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.972 -1.08 . . . . 0.0 110.805 179.208 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.6 ' HB2' HG22 ' A' ' 8' ' ' VAL . 10.0 pt-20 -145.2 140.71 28.09 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.81 -1.181 . . . . 0.0 110.71 178.42 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.27 69.33 1.67 Allowed Glycine 0 N--CA 1.497 2.709 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.402 ' CE2' HG22 ' A' ' 74' ' ' THR . 60.1 p-90 -91.47 -38.41 12.57 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.172 -1.193 . . . . 0.0 110.557 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -53.86 -28.3 35.21 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.08 -1.013 . . . . 0.0 111.261 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -91.19 -36.22 14.07 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.872 -1.143 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.575 HD13 ' CD2' ' A' ' 10' ' ' TYR . 94.5 mt -69.08 -173.93 0.56 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.989 -1.07 . . . . 0.0 109.848 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.34 161.45 30.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.178 -0.952 . . . . 0.0 110.575 -179.562 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -77.6 -36.35 51.97 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.24 -0.912 . . . . 0.0 110.278 179.599 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -52.25 -37.53 55.55 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.989 -1.07 . . . . 0.0 110.126 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.425 ' HG3' ' CE2' ' A' ' 10' ' ' TYR . 0.7 OUTLIER -57.98 -40.57 80.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.205 -0.934 . . . . 0.0 109.311 178.812 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -37.53 64.9 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.325 -0.859 . . . . 0.0 109.984 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -69.0 -41.42 77.84 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.257 -0.902 . . . . 0.0 109.27 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -64.95 -36.32 84.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.229 -0.919 . . . . 0.0 110.022 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.94 -41.1 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 67.8 p -60.15 -38.77 84.15 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.112 -0.992 . . . . 0.0 110.105 179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -58.42 -38.51 77.57 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.214 -0.929 . . . . 0.0 110.061 179.694 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 93' ' ' HIS . . . . . 0.492 ' CD2' HG22 ' A' ' 53' ' ' ILE . 4.8 m80 -65.18 -53.52 43.54 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.552 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.77 -34.73 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.25 179.004 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.3 -39.38 71.49 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.148 -0.97 . . . . 0.0 109.55 179.111 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.54 -37.85 85.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 109.663 179.244 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.6 tp -78.85 -29.74 44.76 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.154 -0.966 . . . . 0.0 110.718 179.461 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -103.6 39.39 1.61 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.871 -1.143 . . . . 0.0 110.49 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.3 m . . . . . 0 N--CA 1.5 2.029 0 O-C-N 121.146 -0.971 . . . . 0.0 110.608 179.756 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mmt . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.99 93.88 4.2 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.22 -0.925 . . . . 0.0 110.242 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -119.11 112.82 20.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.177 -0.952 . . . . 0.0 110.192 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -127.4 128.51 45.95 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.188 -0.945 . . . . 0.0 110.251 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.79 126.37 52.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.184 -0.948 . . . . 0.0 110.145 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.543 ' HB3' HD11 ' A' ' 76' ' ' LEU . 1.7 m-85 -120.77 142.8 49.22 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.27 -0.894 . . . . 0.0 110.186 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.455 ' O ' HG23 ' A' ' 32' ' ' ILE . 84.4 m -133.96 158.92 42.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.2 -0.937 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.73 ' CG2' HD23 ' A' ' 76' ' ' LEU . 58.4 t -116.81 125.76 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.149 -0.969 . . . . 0.0 110.05 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -142.61 158.46 43.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.147 -0.971 . . . . 0.0 110.668 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.446 ' OH ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -106.84 148.51 28.45 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.462 -0.774 . . . . 0.0 110.026 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.71 135.89 57.79 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.218 -0.927 . . . . 0.0 109.809 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -114.32 -56.44 2.39 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 110.291 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -153.36 130.97 11.48 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.181 -0.949 . . . . 0.0 110.655 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.85 158.19 23.43 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.893 HG22 HG22 ' A' ' 26' ' ' VAL . 77.0 p -118.14 136.98 53.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.208 -1.172 . . . . 0.0 110.063 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -129.07 132.17 47.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.126 -0.984 . . . . 0.0 110.483 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.01 111.27 3.96 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.9 t -65.15 157.76 27.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.26 -1.141 . . . . 0.0 109.182 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -87.63 155.54 19.9 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.584 -0.697 . . . . 0.0 110.197 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.54 28.26 4.64 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.266 -0.896 . . . . 0.0 111.914 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 p -172.1 163.82 6.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.787 -1.195 . . . . 0.0 111.295 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.74 53.64 0.86 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.232 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -136.03 -174.63 3.72 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.481 -0.762 . . . . 0.0 110.355 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.6 pttt -139.05 156.44 47.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.636 HG21 ' NH1' ' A' ' 31' ' ' ARG . 41.3 mt -95.52 105.32 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.368 -0.833 . . . . 0.0 109.564 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.893 HG22 HG22 ' A' ' 15' ' ' THR . 57.4 t -108.57 162.75 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.241 -0.912 . . . . 0.0 109.931 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -41.07 126.22 2.55 Favored 'General case' 0 N--CA 1.52 3.057 0 O-C-N 121.668 -0.645 . . . . 0.0 111.548 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 110.3 -3.84 29.78 Favored Glycine 0 N--CA 1.492 2.392 0 C-N-CA 120.111 -1.042 . . . . 0.0 111.125 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.1 t -110.48 134.12 53.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-N 119.564 1.682 . . . . 0.0 109.871 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.8 t -89.88 132.54 35.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.246 -0.909 . . . . 0.0 108.861 178.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.636 ' NH1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -130.86 151.99 50.68 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.145 -0.972 . . . . 0.0 111.308 -178.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 7' ' ' CYS . 38.5 mt -103.71 139.59 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.419 -0.801 . . . . 0.0 109.078 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.17 128.1 9.41 Favored Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 29.7 tttt -110.41 114.96 28.81 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.277 -1.131 . . . . 0.0 109.738 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.528 HG22 ' HB3' ' A' ' 48' ' ' LYS . 61.7 t -98.72 107.76 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.199 -0.938 . . . . 0.0 110.419 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.405 HG23 ' HD2' ' A' ' 37' ' ' PRO . 10.3 p -124.69 143.14 42.64 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.268 -0.895 . . . . 0.0 109.934 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.405 ' HD2' HG23 ' A' ' 36' ' ' VAL . 50.1 Cg_endo -76.11 127.56 10.02 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.261 1.137 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -104.35 116.69 60.84 Favored Pre-proline 0 N--CA 1.499 2.012 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -75.06 76.81 3.31 Favored 'Trans proline' 0 N--CA 1.484 0.946 0 O-C-N 123.122 1.064 . . . . 0.0 110.242 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -149.81 -58.34 0.2 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.186 -0.946 . . . . 0.0 110.59 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.3 t -107.94 158.9 16.96 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.169 -0.957 . . . . 0.0 110.262 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -90.33 -37.61 13.92 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.172 -0.955 . . . . 0.0 110.336 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.9 t -72.21 -40.27 67.96 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.005 -1.06 . . . . 0.0 109.877 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -85.51 77.17 2.1 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.76 -79.07 0.14 Allowed Glycine 0 N--CA 1.493 2.454 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -116.46 137.28 52.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.186 -1.185 . . . . 0.0 110.166 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.3 ttt -116.97 152.28 34.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.234 -0.917 . . . . 0.0 110.244 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HB3' HG22 ' A' ' 35' ' ' VAL . 13.2 pttt -125.03 145.16 50.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.266 -0.896 . . . . 0.0 110.617 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.28 156.62 43.7 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.0 109.652 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -101.55 142.3 33.13 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.15 -0.968 . . . . 0.0 110.127 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -121.3 174.14 6.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.314 -0.866 . . . . 0.0 110.718 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 2.8 m80 -93.65 -173.82 3.29 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.981 HG22 ' CE1' ' A' ' 93' ' ' HIS . 45.5 mm -83.27 -33.73 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.32 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -90.57 -33.89 15.71 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.771 -1.206 . . . . 0.0 110.686 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 73.2 m -63.24 -52.31 62.67 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.927 -1.108 . . . . 0.0 110.307 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.1 88.96 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.275 -0.891 . . . . 0.0 110.375 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.444 ' CE1' HG13 ' A' ' 94' ' ' ILE . 10.4 m-85 -75.17 -30.35 60.7 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.02 -1.072 . . . . 0.0 109.751 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -68.23 -36.18 79.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.981 -1.074 . . . . 0.0 109.564 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 41.2 tttm -59.97 -40.05 87.74 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.996 . . . . 0.0 109.761 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -59.89 -44.91 93.97 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.738 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -58.56 -35.1 71.84 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.212 -0.93 . . . . 0.0 110.436 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 ttt-85 -89.71 -29.2 18.91 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.18 -0.95 . . . . 0.0 111.01 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.15 167.64 1.66 Allowed 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.826 -1.171 . . . . 0.0 110.186 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.9 mmm-85 -63.87 156.83 26.35 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.189 -0.945 . . . . 0.0 110.324 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.31 -33.46 22.09 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.317 -0.865 . . . . 0.0 110.655 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -49.9 -35.22 22.84 Favored 'General case' 0 N--CA 1.515 2.785 0 O-C-N 120.929 -1.107 . . . . 0.0 111.035 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.89 128.09 53.55 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.062 -1.024 . . . . 0.0 109.859 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -114.75 143.32 45.26 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.192 -0.942 . . . . 0.0 110.424 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.9 mtpt -126.62 149.78 49.29 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.202 -0.936 . . . . 0.0 109.999 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.4 mt 54.36 98.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.116 -0.99 . . . . 0.0 110.562 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -110.29 141.77 42.84 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.139 -0.976 . . . . 0.0 110.02 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -165.56 0.08 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.056 -1.027 . . . . 0.0 110.516 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.559 HD21 ' HG3' ' A' ' 87' ' ' LYS . 15.9 tp -114.72 37.64 3.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.139 -0.975 . . . . 0.0 110.508 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -152.96 36.74 0.49 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.067 -1.021 . . . . 0.0 110.8 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.653 ' O ' HD12 ' A' ' 76' ' ' LEU . 48.1 mm-40 -125.35 38.81 4.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.119 -0.988 . . . . 0.0 109.776 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.73 HD23 ' CG2' ' A' ' 8' ' ' VAL . 1.0 OUTLIER -147.82 153.67 39.48 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.213 -0.93 . . . . 0.0 110.109 -179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -89.95 97.67 11.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.116 -0.99 . . . . 0.0 110.065 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.19 -35.25 0.84 Allowed Glycine 0 N--CA 1.495 2.63 0 C-N-CA 119.724 -1.227 . . . . 0.0 110.963 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.448 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 27.2 p-90 -52.09 -30.66 27.07 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.006 1.403 . . . . 0.0 111.062 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.448 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.6 tm-20 -60.0 -42.98 95.46 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 120.907 -1.121 . . . . 0.0 109.684 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.31 -39.46 90.58 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.172 -0.955 . . . . 0.0 109.816 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.6 mp -49.93 173.72 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.855 0 O-C-N 121.17 -0.956 . . . . 0.0 110.759 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -107.13 161.85 14.39 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.178 -0.951 . . . . 0.0 110.388 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.19 -43.9 74.82 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.132 -0.98 . . . . 0.0 110.481 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -62.43 -51.15 68.67 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.262 -0.899 . . . . 0.0 109.43 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.446 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 0.6 OUTLIER -62.19 -38.88 90.8 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.297 -0.877 . . . . 0.0 109.331 179.031 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.559 ' HG3' HD21 ' A' ' 73' ' ' LEU . 24.3 tttt -59.43 -39.19 82.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.233 -0.917 . . . . 0.0 109.775 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -59.99 -40.0 87.64 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.715 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.12 -38.94 92.86 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.219 -0.926 . . . . 0.0 110.019 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.49 ' CD1' HD12 ' A' ' 53' ' ' ILE . 45.9 mm -68.45 -41.51 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.152 -0.967 . . . . 0.0 109.026 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.543 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -60.55 -38.17 83.62 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.23 -0.919 . . . . 0.0 109.935 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -58.93 -40.23 83.97 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.149 -0.97 . . . . 0.0 109.991 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.981 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.3 m-70 -59.93 -47.61 85.08 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.206 -0.934 . . . . 0.0 109.933 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' CE1' ' A' ' 57' ' ' PHE . 19.4 mt -63.67 -39.25 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.202 -0.936 . . . . 0.0 109.61 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.03 95.83 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.216 -0.927 . . . . 0.0 109.438 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.24 -40.44 67.71 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.229 -0.919 . . . . 0.0 109.088 178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.425 HD22 ' HD1' ' A' ' 57' ' ' PHE . 50.1 tp -68.45 -33.12 73.62 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.196 -0.94 . . . . 0.0 110.228 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.7 t -93.96 -58.81 2.13 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.945 -1.097 . . . . 0.0 110.007 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m 52.42 -164.9 0.07 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.04 -1.037 . . . . 0.0 110.89 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 53.65 80.06 0.12 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.069 -1.019 . . . . 0.0 110.704 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -116.98 -57.08 2.2 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.248 -0.907 . . . . 0.0 110.114 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -124.91 -65.46 1.03 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.235 -0.916 . . . . 0.0 110.212 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -141.2 66.72 0.49 Allowed Glycine 0 N--CA 1.494 2.545 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.43 HG23 ' O ' ' A' ' 104' ' ' THR . 8.1 t -155.42 58.43 1.89 Allowed Pre-proline 0 N--CA 1.498 1.965 0 O-C-N 121.167 -1.196 . . . . 0.0 110.719 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.4 108.51 2.53 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 123.288 1.152 . . . . 0.0 110.45 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.7 mtpt -129.84 146.78 51.57 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.202 -0.936 . . . . 0.0 110.212 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -142.81 141.16 31.59 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.195 -0.94 . . . . 0.0 110.223 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 52.4 81.76 0.08 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.051 -1.031 . . . . 0.0 110.838 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -133.12 119.13 19.55 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.201 -0.937 . . . . 0.0 110.246 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.5 146.35 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.223 -0.923 . . . . 0.0 110.191 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.12 142.95 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.256 -0.903 . . . . 0.0 110.261 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -118.35 105.48 11.76 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.204 -0.935 . . . . 0.0 110.286 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.92 136.89 53.19 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.188 -0.945 . . . . 0.0 110.261 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.485 ' C ' HD12 ' A' ' 115' ' ' LEU . 27.5 mmtt -122.84 110.14 15.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.209 -0.932 . . . . 0.0 110.243 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.485 HD12 ' C ' ' A' ' 114' ' ' LYS . 6.7 mp -117.74 136.47 53.35 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.18 -0.95 . . . . 0.0 110.217 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 37.6 p -119.63 142.56 48.32 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 110.239 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.217 179.982 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 110.191 -0.299 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.95 119.16 33.48 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.194 -0.942 . . . . 0.0 110.208 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -124.22 92.54 3.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.197 -0.94 . . . . 0.0 110.171 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -127.57 159.38 34.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.23 -0.919 . . . . 0.0 110.228 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -119.82 138.44 53.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.264 -0.898 . . . . 0.0 110.205 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.642 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.9 m-85 -118.21 150.06 40.04 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.219 -0.925 . . . . 0.0 110.284 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.9 m -134.15 156.39 48.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.262 -0.899 . . . . 0.0 110.032 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 52.6 t -109.82 135.54 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.118 -0.989 . . . . 0.0 110.028 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -148.35 153.58 38.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.185 -0.947 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -110.87 148.44 32.42 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.41 -0.807 . . . . 0.0 109.549 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.29 130.92 41.91 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.514 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -138.05 -65.68 0.51 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.171 -0.956 . . . . 0.0 110.432 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -116.98 110.87 18.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.214 -0.929 . . . . 0.0 110.318 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.18 142.34 10.49 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 25' ' ' ILE . 5.4 m -116.26 135.88 53.5 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.205 -1.174 . . . . 0.0 110.048 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.28 144.51 31.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.182 -0.949 . . . . 0.0 110.51 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -68.7 156.34 53.35 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -91.83 143.86 26.08 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.211 -1.17 . . . . 0.0 108.726 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CB ' ' CE2' ' A' ' 51' ' ' TYR . 4.3 mmtt -52.91 147.32 9.32 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 120.86 -1.15 . . . . 0.0 110.311 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt 53.28 62.01 2.87 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.137 -0.977 . . . . 0.0 110.242 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.3 t -172.49 148.7 2.04 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.917 -1.114 . . . . 0.0 111.913 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -107.45 45.99 0.97 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -132.51 -171.84 2.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.591 -0.693 . . . . 0.0 109.956 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -135.3 153.09 51.99 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.026 -1.047 . . . . 0.0 110.535 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.721 HG23 ' CG2' ' A' ' 29' ' ' VAL . 72.0 mt -107.01 112.88 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.371 -0.83 . . . . 0.0 109.6 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.493 HG22 ' HG2' ' A' ' 27' ' ' LYS . 13.4 p -111.11 161.19 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.195 -0.941 . . . . 0.0 110.609 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.493 ' HG2' HG22 ' A' ' 26' ' ' VAL . 1.6 ptpp? -46.22 120.24 2.7 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 121.437 -0.79 . . . . 0.0 111.282 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 125.22 -22.0 6.37 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.999 -1.096 . . . . 0.0 111.004 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.721 ' CG2' HG23 ' A' ' 25' ' ' ILE . 8.9 m -100.69 138.21 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 CA-C-N 119.342 1.571 . . . . 0.0 110.52 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 42.4 t -82.66 141.96 32.08 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.233 -0.917 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.45 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 3.5 ptt85 -138.19 150.41 46.73 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.325 -0.859 . . . . 0.0 110.174 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.1 mt -105.62 144.25 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.293 -0.879 . . . . 0.0 109.98 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.89 132.13 10.99 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.424 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 27.5 ttpt -116.36 115.33 25.69 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.095 -1.238 . . . . 0.0 110.066 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.446 HG22 ' HG3' ' A' ' 48' ' ' LYS . 59.0 t -102.12 111.13 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.158 -0.964 . . . . 0.0 110.436 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.8 p -122.51 143.4 39.63 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.195 -0.94 . . . . 0.0 110.257 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -78.38 150.03 24.99 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 O-C-N 123.123 1.065 . . . . 0.0 110.634 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 -102.9 162.76 19.15 Favored Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 121.306 -0.872 . . . . 0.0 110.108 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.13 105.66 1.88 Allowed 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.386 1.203 . . . . 0.0 110.218 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.5 t80 55.26 100.11 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.136 -0.977 . . . . 0.0 110.574 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.5 m -116.94 134.8 54.29 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.119 -0.988 . . . . 0.0 110.197 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -102.26 -48.58 4.15 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.171 -0.955 . . . . 0.0 110.358 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.8 m -88.83 -41.18 12.64 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.17 -0.956 . . . . 0.0 110.256 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -113.82 -170.02 17.06 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.719 -1.352 . . . . 0.0 109.719 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.93 -59.69 0.01 OUTLIER Glycine 0 N--CA 1.497 2.734 0 N-CA-C 109.824 -1.311 . . . . 0.0 109.824 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -114.57 152.71 31.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.192 -1.181 . . . . 0.0 110.037 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.0 mmt -112.56 124.97 53.73 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.276 -0.89 . . . . 0.0 110.35 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.446 ' HG3' HG22 ' A' ' 35' ' ' VAL . 21.0 ttmt -117.7 122.27 43.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.213 -0.929 . . . . 0.0 110.147 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -127.44 152.21 47.83 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.194 -0.942 . . . . 0.0 109.85 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 72.1 m95 -98.83 141.93 30.99 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.234 -0.916 . . . . 0.0 110.081 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CE2' ' CB ' ' A' ' 19' ' ' LYS . 96.0 m-85 -120.73 174.25 6.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.304 -0.873 . . . . 0.0 110.465 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -95.24 -173.12 2.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.949 HG22 ' CE1' ' A' ' 93' ' ' HIS . 40.9 mm -87.16 -37.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.051 -1.031 . . . . 0.0 109.263 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -88.99 -27.95 20.54 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.887 -1.133 . . . . 0.0 110.821 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 65.7 m -71.58 -49.15 43.14 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.966 -1.084 . . . . 0.0 109.911 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.35 -37.34 83.09 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.36 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.448 ' CE1' HG13 ' A' ' 94' ' ' ILE . 5.9 m-85 -74.33 -32.8 62.96 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 118.952 -1.099 . . . . 0.0 109.588 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -63.37 -36.74 84.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.49 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 24.9 mtpp -59.9 -40.02 87.35 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.135 -0.978 . . . . 0.0 109.779 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -58.11 -45.28 87.52 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.179 -0.95 . . . . 0.0 109.262 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -59.56 -36.07 75.47 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 119.574 -0.851 . . . . 0.0 109.407 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -108.61 32.3 4.96 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.311 -0.868 . . . . 0.0 110.368 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.604 ' HB2' ' O ' ' A' ' 59' ' ' LYS . . . -110.98 168.39 9.52 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.909 -1.119 . . . . 0.0 110.22 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.5 mtt-85 -74.57 157.02 36.18 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.254 -0.904 . . . . 0.0 110.129 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.78 -33.73 22.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.271 -0.893 . . . . 0.0 110.603 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.6 p -50.41 -35.3 27.83 Favored 'General case' 0 N--CA 1.515 2.79 0 O-C-N 120.94 -1.1 . . . . 0.0 111.024 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 37.3 m -108.33 136.89 47.21 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.137 -0.977 . . . . 0.0 110.014 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.8 tptt -117.08 144.3 44.82 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.216 -0.928 . . . . 0.0 110.379 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -129.96 139.42 51.08 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.114 -0.991 . . . . 0.0 110.161 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.568 HG23 HD11 ' A' ' 76' ' ' LEU . 77.2 mt 55.18 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.202 -0.936 . . . . 0.0 110.791 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -108.91 141.45 40.96 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.197 -0.94 . . . . 0.0 109.961 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 53.17 -173.06 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.987 -1.071 . . . . 0.0 110.677 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.677 HD22 ' OG1' ' A' ' 91' ' ' THR . 14.1 tp -98.39 -35.53 10.26 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.178 -0.951 . . . . 0.0 111.102 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -102.8 50.23 0.82 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.918 -1.114 . . . . 0.0 110.446 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -125.5 38.17 4.22 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.196 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 6' ' ' PHE . 48.4 mt -145.48 155.2 42.96 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.216 -0.927 . . . . 0.0 110.135 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -84.46 97.69 9.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.055 -1.028 . . . . 0.0 110.277 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.72 -37.32 0.62 Allowed Glycine 0 N--CA 1.497 2.736 0 C-N-CA 119.689 -1.243 . . . . 0.0 111.036 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.451 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 34.8 p-90 -55.22 -33.3 62.96 Favored 'General case' 0 N--CA 1.513 2.717 0 O-C-N 120.872 -1.369 . . . . 0.0 110.728 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.451 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.2 tt0 -54.18 -39.48 66.65 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.91 -1.119 . . . . 0.0 110.243 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -72.25 -36.43 69.07 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.212 -0.93 . . . . 0.0 110.02 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.43 HD23 ' CB ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -53.25 -179.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.793 0 O-C-N 121.104 -0.998 . . . . 0.0 110.343 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -106.76 161.07 14.99 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.12 -0.987 . . . . 0.0 110.33 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.41 -39.94 81.12 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.391 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -66.23 -42.3 88.83 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.585 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.43 ' CB ' HD23 ' A' ' 82' ' ' LEU . 75.8 mt-10 -66.73 -39.89 88.16 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.539 -0.864 . . . . 0.0 109.359 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.691 ' HA ' HD12 ' A' ' 90' ' ' ILE . 35.8 mtpt -60.54 -38.38 84.29 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.265 -0.897 . . . . 0.0 109.9 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.02 -40.36 84.74 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.879 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.44 -40.19 96.49 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 87' ' ' LYS . 12.0 mt -65.38 -40.79 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.235 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.677 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.9 OUTLIER -59.22 -38.76 80.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.177 -0.952 . . . . 0.0 109.958 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -39.94 80.52 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.283 -0.886 . . . . 0.0 109.897 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.949 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.5 m-70 -58.35 -47.39 83.93 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.135 -0.978 . . . . 0.0 109.846 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.448 HG13 ' CE1' ' A' ' 57' ' ' PHE . 26.0 mt -66.12 -38.23 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.241 -0.912 . . . . 0.0 109.511 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.43 81.1 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.127 -0.983 . . . . 0.0 109.386 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.46 -41.89 68.84 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.217 -0.927 . . . . 0.0 108.836 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.425 HD22 ' HD1' ' A' ' 57' ' ' PHE . 28.5 tp -71.0 -33.64 70.6 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.345 -0.847 . . . . 0.0 109.815 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 41.3 m -100.67 46.73 0.94 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.968 -1.082 . . . . 0.0 110.075 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.5 t -120.37 139.16 53.2 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.174 -0.954 . . . . 0.0 110.368 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -144.89 48.98 1.3 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.231 -0.918 . . . . 0.0 110.29 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -141.67 56.97 1.5 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.154 -0.966 . . . . 0.0 110.281 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.08 57.65 1.27 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.022 -1.049 . . . . 0.0 110.302 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -140.52 -94.39 0.25 Allowed Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.448 ' OG1' ' HD3' ' A' ' 105' ' ' PRO . 0.0 OUTLIER -63.91 -57.83 17.15 Favored Pre-proline 0 N--CA 1.508 2.456 0 O-C-N 121.192 -1.181 . . . . 0.0 110.195 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.448 ' HD3' ' OG1' ' A' ' 104' ' ' THR . 47.5 Cg_endo -73.5 134.31 20.35 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.28 1.147 . . . . 0.0 110.43 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -128.99 170.15 13.81 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.15 -0.969 . . . . 0.0 110.245 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? 53.19 179.91 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.007 -1.058 . . . . 0.0 110.756 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -152.38 -174.12 4.78 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.212 -0.93 . . . . 0.0 110.675 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.07 161.87 18.24 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.213 -0.929 . . . . 0.0 110.242 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.0 t -123.51 106.55 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.167 -0.958 . . . . 0.0 110.041 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.8 m -138.08 142.29 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.2 -0.937 . . . . 0.0 110.266 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -132.07 141.93 49.36 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.12 -0.988 . . . . 0.0 110.172 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.41 105.49 10.56 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.24 -0.912 . . . . 0.0 110.268 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.6 tptt -121.21 147.44 45.61 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.263 -0.898 . . . . 0.0 110.273 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.2 tp -117.99 139.42 51.2 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.116 -0.99 . . . . 0.0 110.241 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.2 m -124.71 140.46 52.91 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.223 -0.923 . . . . 0.0 110.241 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.201 -180.0 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.6 mtt . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.94 86.77 2.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 110.231 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -131.79 164.14 26.67 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.147 -0.97 . . . . 0.0 110.203 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -116.23 135.55 53.8 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.186 -0.946 . . . . 0.0 110.111 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.06 121.65 32.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.197 -0.939 . . . . 0.0 110.308 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.595 ' HD1' HG22 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -112.5 144.49 41.87 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.171 -0.955 . . . . 0.0 109.722 179.687 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.7 p -135.65 164.62 27.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.899 . . . . 0.0 110.177 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.708 HG13 HD12 ' A' ' 76' ' ' LEU . 34.1 m -125.26 140.77 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.173 -0.955 . . . . 0.0 110.955 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -146.78 97.4 2.9 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.146 -0.971 . . . . 0.0 110.163 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.62 ' CD2' HD13 ' A' ' 82' ' ' LEU . 7.3 m-85 -54.06 154.61 4.09 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.188 -0.945 . . . . 0.0 110.456 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.524 ' HB2' ' HE ' ' A' ' 31' ' ' ARG . . . -108.32 131.21 54.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.279 -0.888 . . . . 0.0 110.696 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -117.09 -57.81 2.12 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.242 -0.911 . . . . 0.0 109.912 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.7 mtm-85 -119.12 159.43 23.97 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.242 -0.912 . . . . 0.0 110.02 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.758 ' O ' HG23 ' A' ' 26' ' ' VAL . . . 81.64 162.42 29.59 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.53 HG23 ' HB ' ' A' ' 26' ' ' VAL . 17.5 m -133.86 144.21 48.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.144 -1.21 . . . . 0.0 110.322 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -135.77 143.42 45.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.737 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -74.37 123.51 7.78 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 11.0 t -62.35 130.61 46.05 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.272 -1.134 . . . . 0.0 109.412 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -61.89 147.8 45.54 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.173 -0.954 . . . . 0.0 109.209 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? 52.87 46.88 25.87 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.994 -1.066 . . . . 0.0 109.567 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.2 t -165.59 153.93 11.36 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.343 -0.848 . . . . 0.0 110.944 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -105.38 44.66 1.02 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -138.7 -175.03 4.0 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.464 -0.772 . . . . 0.0 109.978 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB3' HG22 ' A' ' 15' ' ' THR . 0.0 OUTLIER -133.56 157.24 46.18 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.203 -0.935 . . . . 0.0 110.06 -179.382 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.923 HG23 ' CG1' ' A' ' 29' ' ' VAL . 59.7 mt -112.61 123.28 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.395 -0.816 . . . . 0.0 109.956 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 14' ' ' GLY . 8.9 p -165.45 112.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.112 -0.992 . . . . 0.0 111.364 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.47 126.76 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.198 -0.939 . . . . 0.0 111.632 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.48 9.34 81.77 Favored Glycine 0 N--CA 1.496 2.652 0 O-C-N 121.077 -1.014 . . . . 0.0 111.808 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.923 ' CG1' HG23 ' A' ' 25' ' ' ILE . 95.1 t -126.66 135.59 63.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.708 1.754 . . . . 0.0 110.085 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.882 ' HB3' HD11 ' A' ' 53' ' ' ILE . 5.4 t -95.78 134.91 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.179 -0.95 . . . . 0.0 109.24 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.844 ' CG ' HG21 ' A' ' 25' ' ' ILE . 25.3 mtm180 -113.6 129.3 56.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.127 -0.983 . . . . 0.0 110.771 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.595 HG22 ' HD1' ' A' ' 6' ' ' PHE . 12.2 mt -103.81 128.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.215 -0.928 . . . . 0.0 108.515 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.9 130.52 10.27 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 21.0 tttm -107.03 113.53 27.06 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.334 -1.098 . . . . 0.0 109.393 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.491 HG22 ' HB3' ' A' ' 48' ' ' LYS . 48.7 t -96.72 112.76 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.142 -0.973 . . . . 0.0 110.538 -179.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.1 t -120.77 111.03 34.69 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -73.39 127.35 11.77 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.205 1.108 . . . . 0.0 110.427 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -104.26 116.9 60.57 Favored Pre-proline 0 N--CA 1.499 1.99 0 O-C-N 121.179 -0.95 . . . . 0.0 110.084 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.27 76.95 2.95 Favored 'Trans proline' 0 C--N 1.32 -0.969 0 O-C-N 123.196 1.103 . . . . 0.0 110.282 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -147.33 -58.74 0.27 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.106 -0.996 . . . . 0.0 110.479 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -106.98 158.05 17.33 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.237 -0.915 . . . . 0.0 110.193 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -94.41 -38.84 10.76 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.255 -0.903 . . . . 0.0 110.345 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.2 p -57.37 -39.68 76.52 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.13 -0.981 . . . . 0.0 110.152 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.58 107.48 3.38 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -84.68 -70.92 1.33 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -134.58 138.87 44.94 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.235 -1.156 . . . . 0.0 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.2 mtp -117.02 149.58 40.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.173 -0.954 . . . . 0.0 110.233 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HB3' HG22 ' A' ' 35' ' ' VAL . 24.0 pttt -129.46 144.91 51.45 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.32 -0.862 . . . . 0.0 110.534 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -122.76 148.06 45.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.147 -0.971 . . . . 0.0 109.581 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -93.99 151.07 19.8 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.104 -0.997 . . . . 0.0 110.133 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -135.03 173.22 11.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.279 -0.888 . . . . 0.0 110.414 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.436 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -96.03 -172.34 2.54 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.876 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.928 HG22 ' CE1' ' A' ' 93' ' ' HIS . 43.6 mm -84.38 -39.85 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 121.09 -1.006 . . . . 0.0 108.777 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -89.02 -25.68 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.922 -1.111 . . . . 0.0 111.081 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.7 m -75.95 -42.2 49.31 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.78 -1.2 . . . . 0.0 109.987 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -38.18 66.62 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.86 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.456 ' CE1' HG13 ' A' ' 94' ' ' ILE . 6.9 m-85 -73.6 -31.82 63.78 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 119.029 -1.068 . . . . 0.0 109.553 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -63.91 -38.24 90.37 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.052 -1.03 . . . . 0.0 109.337 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -41.17 97.7 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.515 179.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.99 -46.02 90.84 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.287 -0.883 . . . . 0.0 109.302 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -56.35 -33.73 65.95 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.765 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 24.7 mtp-105 -105.85 30.24 5.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.174 -0.953 . . . . 0.0 110.627 179.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -107.69 167.83 9.68 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.906 -1.121 . . . . 0.0 109.97 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.0 mtp85 -63.29 155.18 29.3 Favored 'General case' 0 N--CA 1.508 2.441 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.002 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.38 -34.74 20.11 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.265 -0.897 . . . . 0.0 110.632 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.05 -36.91 51.89 Favored 'General case' 0 N--CA 1.513 2.686 0 O-C-N 120.964 -1.085 . . . . 0.0 110.708 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.3 m -113.88 119.98 39.13 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.125 -0.984 . . . . 0.0 110.174 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.9 tptm -121.34 145.02 48.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.23 -0.919 . . . . 0.0 110.266 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 158.22 30.74 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.233 -0.917 . . . . 0.0 110.256 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.3 mt 54.41 98.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.126 -0.984 . . . . 0.0 110.661 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -114.2 138.06 50.96 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.183 -0.948 . . . . 0.0 110.069 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.33 -166.01 0.07 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.061 -1.024 . . . . 0.0 110.596 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.749 HD22 ' OG1' ' A' ' 91' ' ' THR . 4.5 tp -115.63 39.54 2.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.176 -0.953 . . . . 0.0 110.374 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.599 HG22 ' CZ2' ' A' ' 79' ' ' TRP . 2.9 p -149.28 38.04 0.78 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.577 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.679 ' C ' HD22 ' A' ' 76' ' ' LEU . 3.2 mp0 -137.02 37.08 2.57 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.23 -0.919 . . . . 0.0 110.247 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.708 HD12 HG13 ' A' ' 8' ' ' VAL . 4.2 mm? -122.09 152.25 40.04 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.113 -0.992 . . . . 0.0 109.906 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.35 106.76 0.8 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.312 -0.868 . . . . 0.0 111.359 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 65.81 59.31 7.73 Favored Glycine 0 N--CA 1.492 2.423 0 O-C-N 121.247 -0.908 . . . . 0.0 111.161 178.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.599 ' CZ2' HG22 ' A' ' 74' ' ' THR . 34.9 p-90 -88.94 -38.19 14.67 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.967 -1.314 . . . . 0.0 109.952 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.474 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 8.5 tm-20 -69.2 -40.74 77.87 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.164 -0.96 . . . . 0.0 109.082 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.24 -28.02 50.36 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.199 -0.938 . . . . 0.0 111.144 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.62 HD13 ' CD2' ' A' ' 10' ' ' TYR . 95.6 mt -69.81 -175.06 0.83 Allowed 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.624 -1.297 . . . . 0.0 109.762 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -62.76 155.25 27.18 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.168 -0.957 . . . . 0.0 110.06 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -87.88 -41.07 13.46 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.241 -0.912 . . . . 0.0 110.192 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -65.66 -43.99 87.7 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.28 -0.887 . . . . 0.0 109.56 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 47.8 mt-10 -64.63 -39.47 93.76 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.332 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.49 ' HG3' HD21 ' A' ' 73' ' ' LEU . 12.7 tptt -58.52 -39.16 79.34 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.257 -0.902 . . . . 0.0 109.76 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.7 -37.93 74.33 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.242 -0.911 . . . . 0.0 109.969 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -59.24 -39.22 82.08 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.232 -0.917 . . . . 0.0 110.062 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 70.2 mt -64.53 -41.05 91.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 O-C-N 121.169 -0.957 . . . . 0.0 109.058 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.749 ' OG1' HD22 ' A' ' 73' ' ' LEU . 2.0 m -57.08 -38.45 73.34 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.179 -0.95 . . . . 0.0 109.966 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.11 -40.35 80.99 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.223 -0.923 . . . . 0.0 109.8 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.928 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.1 m-70 -60.39 -50.59 72.98 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.163 -0.961 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.456 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.0 mt -62.5 -39.44 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 109.471 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.67 -41.31 96.18 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.218 -0.926 . . . . 0.0 109.272 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.53 -40.99 69.71 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.028 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.9 tp -69.64 -33.85 73.2 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.282 -0.886 . . . . 0.0 110.073 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 18.2 t -96.44 -65.5 0.96 Allowed 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.1 t 52.39 94.7 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.079 -1.013 . . . . 0.0 110.792 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.27 85.63 2.07 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.226 -0.921 . . . . 0.0 110.27 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -138.95 169.71 17.3 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.158 -0.964 . . . . 0.0 110.161 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.42 87.16 2.11 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.213 -0.93 . . . . 0.0 110.173 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -131.07 -91.79 0.57 Allowed Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -119.19 83.14 24.11 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.178 -1.189 . . . . 0.0 110.223 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.7 -172.48 0.95 Allowed 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.417 1.219 . . . . 0.0 110.409 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -117.57 141.97 47.74 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.175 -0.953 . . . . 0.0 110.247 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -124.42 79.86 1.79 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.186 -0.946 . . . . 0.0 110.166 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -139.48 98.06 3.41 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.196 -0.94 . . . . 0.0 110.216 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.32 111.67 17.64 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.148 -0.97 . . . . 0.0 110.268 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' VAL . . . . . 0.457 HG13 ' O ' ' A' ' 110' ' ' VAL . 10.5 p -131.86 124.04 52.69 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.179 -0.951 . . . . 0.0 110.527 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.0 t -138.31 132.28 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.133 -0.979 . . . . 0.0 110.014 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -118.47 125.69 50.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.189 -0.944 . . . . 0.0 110.23 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.07 111.79 19.37 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.228 -0.92 . . . . 0.0 110.265 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -117.42 98.05 6.21 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.142 -0.974 . . . . 0.0 110.18 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.4 tp -120.07 135.85 54.79 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.229 -0.92 . . . . 0.0 110.297 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.401 ' O ' ' OG1' ' A' ' 117' ' ' THR . 11.2 m -127.1 117.67 22.86 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.17 -0.956 . . . . 0.0 110.229 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 116' ' ' THR . 78.9 p . . . . . 0 N--CA 1.504 2.266 0 CA-C-O 118.106 -0.95 . . . . 0.0 111.48 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.9 mtm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.686 0.279 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.78 80.49 1.85 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.193 -0.942 . . . . 0.0 110.118 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -138.12 68.71 1.39 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.209 -0.932 . . . . 0.0 110.221 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.634 ' HA ' HG12 ' A' ' 36' ' ' VAL . 2.7 tt0 57.68 107.92 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.081 -1.012 . . . . 0.0 110.814 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -128.13 137.48 52.13 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.134 -0.978 . . . . 0.0 110.271 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.697 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.5 m-85 -115.98 137.65 51.92 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.136 -0.978 . . . . 0.0 110.162 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -122.25 164.93 17.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.25 -0.906 . . . . 0.0 109.308 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.544 HG12 HG23 ' A' ' 32' ' ' ILE . 32.7 m -134.97 134.3 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.926 -1.109 . . . . 0.0 110.815 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -139.93 147.63 40.81 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.211 -0.93 . . . . 0.0 109.876 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.569 ' HD2' HD22 ' A' ' 82' ' ' LEU . 1.7 m-85 -101.44 148.03 25.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.239 -0.913 . . . . 0.0 109.985 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.642 ' HB2' ' HD2' ' A' ' 31' ' ' ARG . . . -108.09 144.87 34.87 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.289 -0.882 . . . . 0.0 110.557 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -115.17 -56.4 2.37 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.224 -0.923 . . . . 0.0 110.122 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 mtt85 -141.39 72.95 1.4 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.565 ' O ' HG22 ' A' ' 26' ' ' VAL . . . -141.48 -176.2 15.61 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.459 ' HA ' HG22 ' A' ' 26' ' ' VAL . 34.9 m -140.22 116.16 10.35 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.154 -1.204 . . . . 0.0 110.235 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.19 133.3 24.36 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.163 -0.96 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -76.62 123.33 6.66 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.2 t -61.4 127.78 33.14 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.266 -1.138 . . . . 0.0 109.483 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -61.51 147.94 43.69 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.188 -0.945 . . . . 0.0 109.201 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 54.21 44.24 29.4 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.872 -1.142 . . . . 0.0 109.468 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.4 t -165.87 149.65 7.92 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.374 -0.829 . . . . 0.0 110.692 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 tttt -101.09 51.27 0.85 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 0.0 108.678 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.16 -174.99 4.44 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.453 -0.78 . . . . 0.0 110.339 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -133.67 161.05 35.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.184 -0.947 . . . . 0.0 109.759 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.822 HG23 ' CG1' ' A' ' 29' ' ' VAL . 51.7 mt -111.28 110.86 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.408 -0.808 . . . . 0.0 109.775 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 14' ' ' GLY . 57.5 t -141.04 103.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.134 -0.978 . . . . 0.0 111.455 -179.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.8 tttp 59.91 142.4 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.204 -0.935 . . . . 0.0 112.171 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.94 12.64 65.31 Favored Glycine 0 N--CA 1.497 2.754 0 O-C-N 121.088 -1.008 . . . . 0.0 111.841 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.822 ' CG1' HG23 ' A' ' 25' ' ' ILE . 84.0 t -128.77 136.65 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 CA-C-N 119.786 1.793 . . . . 0.0 110.486 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.886 ' HB3' HD11 ' A' ' 53' ' ' ILE . 3.0 t -94.57 131.55 40.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.284 -0.885 . . . . 0.0 108.788 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 11' ' ' ALA . 8.7 mtp180 -106.52 129.31 54.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.149 -0.969 . . . . 0.0 110.719 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.544 HG23 HG12 ' A' ' 8' ' ' VAL . 12.2 mt -104.31 127.11 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.91 126.97 9.07 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.422 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.7 ttpm? -103.44 107.83 18.83 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.365 -1.079 . . . . 0.0 109.331 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -102.03 107.86 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.161 -0.962 . . . . 0.0 110.605 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.634 HG12 ' HA ' ' A' ' 4' ' ' GLN . 34.4 m -123.57 146.22 49.4 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.282 -0.886 . . . . 0.0 109.778 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -76.04 135.62 17.42 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.224 1.118 . . . . 0.0 110.353 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -103.36 143.17 26.08 Favored Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 121.182 -0.949 . . . . 0.0 109.886 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.54 71.36 3.19 Favored 'Trans proline' 0 N--CA 1.486 1.033 0 O-C-N 123.255 1.134 . . . . 0.0 110.213 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -148.0 -58.83 0.25 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.16 -0.962 . . . . 0.0 110.495 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -113.13 155.75 24.41 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.127 -0.983 . . . . 0.0 110.239 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -97.86 -36.77 10.07 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.221 -0.924 . . . . 0.0 110.772 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.0 m -87.37 -40.18 14.65 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.932 -1.105 . . . . 0.0 110.04 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -128.45 82.98 0.33 Allowed Glycine 0 N--CA 1.494 2.517 0 N-CA-C 109.426 -1.47 . . . . 0.0 109.426 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -136.91 59.56 0.63 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -134.32 142.21 47.18 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.239 -1.153 . . . . 0.0 110.039 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 34.8 mtp -117.71 137.09 52.92 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.117 -0.989 . . . . 0.0 110.618 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -131.56 129.11 40.56 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.218 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -132.84 155.01 49.76 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.206 -0.934 . . . . 0.0 109.888 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -98.49 163.37 12.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.115 -0.99 . . . . 0.0 110.006 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -145.71 172.37 13.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.227 -0.92 . . . . 0.0 110.596 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 -172.27 2.68 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.941 HG22 ' CE1' ' A' ' 93' ' ' HIS . 45.2 mm -86.72 -40.07 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.088 0 O-C-N 121.021 -1.049 . . . . 0.0 108.999 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -89.32 -24.47 22.0 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 120.864 -1.148 . . . . 0.0 111.012 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.4 m -75.17 -44.87 44.3 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.734 -1.229 . . . . 0.0 110.01 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -37.66 69.3 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.919 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.451 ' CE1' HG13 ' A' ' 94' ' ' ILE . 8.0 m-85 -74.08 -31.8 62.98 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.417 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.08 -37.75 88.44 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.002 -1.061 . . . . 0.0 109.531 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 7.0 tttp -58.71 -39.56 81.14 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.117 -0.989 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.3 mp -59.35 -43.33 92.81 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.264 -0.898 . . . . 0.0 109.299 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -36.16 74.95 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.282 -0.886 . . . . 0.0 109.513 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.3 mmt-85 -105.86 31.28 5.15 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.241 -0.912 . . . . 0.0 110.561 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 59' ' ' LYS . . . -109.11 168.6 9.26 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.907 -1.121 . . . . 0.0 110.109 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.4 mtm-85 -80.62 157.08 26.09 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.28 -0.888 . . . . 0.0 110.243 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -78.46 -33.7 48.21 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.163 -0.961 . . . . 0.0 110.542 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.0 m -50.9 -35.93 35.53 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 120.943 -1.098 . . . . 0.0 110.869 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.51 147.4 34.21 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.102 -0.999 . . . . 0.0 110.011 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -133.97 145.51 49.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.196 -0.94 . . . . 0.0 110.393 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 22.9 mtmm -131.04 148.96 52.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.168 -0.958 . . . . 0.0 110.218 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.691 HG23 HD11 ' A' ' 76' ' ' LEU . 76.4 mt 53.78 97.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.091 -1.006 . . . . 0.0 110.809 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -113.32 133.76 54.96 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.197 -0.939 . . . . 0.0 109.692 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 53.08 -170.54 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.958 -1.089 . . . . 0.0 110.333 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.492 HD21 ' HG2' ' A' ' 87' ' ' LYS . 27.5 tp -108.39 -58.58 1.98 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.081 -1.012 . . . . 0.0 110.051 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -33.74 70.16 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.166 -0.959 . . . . 0.0 110.544 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -49.07 -33.78 12.26 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 120.989 -1.07 . . . . 0.0 111.462 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 6' ' ' PHE . 54.7 mt -82.65 152.38 25.88 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.008 -1.058 . . . . 0.0 109.994 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -92.75 136.58 33.11 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.266 -0.896 . . . . 0.0 110.572 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 136.75 -47.49 0.96 Allowed Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.512 ' HA ' HD12 ' A' ' 82' ' ' LEU . 54.7 p-90 -50.48 -30.24 12.3 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.15 -1.206 . . . . 0.0 111.449 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.444 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 6.4 tm-20 -52.52 -28.85 22.29 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.883 -1.136 . . . . 0.0 111.28 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -113.06 29.31 8.08 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.95 -1.094 . . . . 0.0 111.788 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.569 HD22 ' HD2' ' A' ' 10' ' ' TYR . 33.3 mt -113.28 -165.85 1.03 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.854 -1.154 . . . . 0.0 109.799 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -100.78 162.21 13.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.049 -1.032 . . . . 0.0 110.068 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -79.12 -39.77 32.77 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.202 -0.936 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -69.19 -41.42 77.16 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.159 -0.963 . . . . 0.0 109.501 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -39.15 73.05 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.918 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.579 ' HA ' HD12 ' A' ' 90' ' ' ILE . 7.1 ttpt -61.11 -39.23 89.2 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.171 -0.955 . . . . 0.0 109.531 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -56.93 -34.9 68.43 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.141 -0.974 . . . . 0.0 110.212 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -58.12 -39.41 78.63 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.16 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 87' ' ' LYS . 10.9 mt -66.29 -40.88 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.401 0 O-C-N 121.176 -0.953 . . . . 0.0 109.219 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.1 m -58.9 -37.89 77.65 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.256 -0.903 . . . . 0.0 110.0 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -58.9 -40.47 84.58 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.154 -0.966 . . . . 0.0 109.822 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.941 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.7 m-70 -60.38 -49.66 76.7 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.155 -0.966 . . . . 0.0 109.75 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.451 HG13 ' CE1' ' A' ' 57' ' ' PHE . 13.9 mt -63.79 -39.4 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.215 -0.928 . . . . 0.0 109.565 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.18 -40.7 98.27 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.142 -0.974 . . . . 0.0 109.341 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -71.86 -38.3 70.08 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.261 -0.9 . . . . 0.0 109.226 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.0 tp -72.95 -37.34 67.16 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.271 -0.893 . . . . 0.0 109.951 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 m -65.28 -51.47 60.57 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.098 -1.001 . . . . 0.0 109.991 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.07 118.56 30.92 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.173 -0.955 . . . . 0.0 110.305 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.5 tttt -143.44 -59.7 0.41 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.212 -0.93 . . . . 0.0 110.186 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 52.69 61.44 3.19 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.011 -1.056 . . . . 0.0 110.684 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.27 46.8 2.02 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.099 -1.001 . . . . 0.0 110.217 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -131.04 -63.5 0.09 OUTLIER Glycine 0 N--CA 1.493 2.468 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 59.5 m 52.57 73.49 0.94 Allowed Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 121.025 -1.28 . . . . 0.0 110.809 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.13 -173.78 1.37 Allowed 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.301 1.158 . . . . 0.0 110.391 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -131.78 -60.18 0.93 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.176 -0.952 . . . . 0.0 110.313 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -136.44 147.54 47.27 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.188 -0.945 . . . . 0.0 110.31 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -127.62 89.82 3.01 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.279 -0.888 . . . . 0.0 110.164 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -126.08 167.59 15.15 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.247 -0.908 . . . . 0.0 110.207 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 57.4 t -111.65 121.87 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.209 -0.932 . . . . 0.0 110.03 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.2 t -129.68 143.83 39.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.161 -0.962 . . . . 0.0 109.954 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -113.05 116.93 30.68 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.196 -0.94 . . . . 0.0 110.12 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.1 142.25 47.62 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.108 -0.995 . . . . 0.0 110.268 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -111.4 117.69 33.77 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.208 -0.933 . . . . 0.0 110.222 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.0 tp -117.13 141.76 47.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.225 -0.922 . . . . 0.0 110.251 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 m -131.99 100.28 5.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.161 -0.962 . . . . 0.0 110.291 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.131 0 O-C-N 121.06 -1.025 . . . . 0.0 110.778 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ttt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 120.679 0.276 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -116.88 95.58 5.08 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.2 -0.938 . . . . 0.0 110.242 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -117.55 131.33 56.71 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.225 -0.922 . . . . 0.0 110.202 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -141.33 135.44 30.53 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.195 -0.941 . . . . 0.0 110.222 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -124.51 131.61 53.49 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.266 -0.896 . . . . 0.0 110.185 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.718 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.5 m-85 -125.15 136.76 53.93 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.153 -0.967 . . . . 0.0 110.275 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.412 ' O ' HG23 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -121.89 164.12 18.09 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.243 -0.91 . . . . 0.0 109.062 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.479 HG13 ' HB3' ' A' ' 76' ' ' LEU . 25.4 m -130.95 134.98 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.945 -1.097 . . . . 0.0 110.465 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -139.67 156.69 46.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.151 -0.968 . . . . 0.0 110.2 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.622 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.5 OUTLIER -105.97 156.15 18.66 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.366 -0.834 . . . . 0.0 110.069 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.725 ' HB1' ' HA ' ' A' ' 26' ' ' VAL . . . -103.05 102.67 12.71 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.261 -0.899 . . . . 0.0 110.503 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -115.13 -56.21 2.39 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.303 -0.873 . . . . 0.0 109.94 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -114.91 83.19 1.86 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.202 -0.936 . . . . 0.0 110.029 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.675 ' O ' HG23 ' A' ' 26' ' ' VAL . . . 142.08 170.47 12.57 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -143.91 140.84 29.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.175 -1.191 . . . . 0.0 110.531 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.03 147.38 51.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.249 -0.907 . . . . 0.0 110.471 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.43 122.05 5.83 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.499 ' CA ' HD11 ' A' ' 25' ' ' ILE . 7.1 t -64.49 124.54 22.1 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.177 -1.19 . . . . 0.0 109.447 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 148.54 40.32 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.999 -1.063 . . . . 0.0 108.939 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 mttm 52.85 64.1 1.99 Allowed 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.982 -1.074 . . . . 0.0 108.984 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.5 t -172.98 -44.45 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.264 -0.897 . . . . 0.0 112.54 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt 70.08 44.15 0.81 Allowed 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.935 -1.103 . . . . 0.0 108.341 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -141.05 -170.05 2.96 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.539 -0.726 . . . . 0.0 109.364 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -127.6 156.02 42.93 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.883 -1.135 . . . . 0.0 110.92 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.905 HG23 ' CG1' ' A' ' 29' ' ' VAL . 15.8 mt -120.09 104.2 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -0.757 . . . . 0.0 109.615 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.725 ' HA ' ' HB1' ' A' ' 11' ' ' ALA . 10.1 p -163.84 147.59 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.084 -1.01 . . . . 0.0 111.578 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt 53.94 102.82 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.381 -0.824 . . . . 0.0 111.664 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.22 11.28 85.05 Favored Glycine 0 N--CA 1.494 2.549 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.012 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.905 ' CG1' HG23 ' A' ' 25' ' ' ILE . 93.1 t -121.78 135.2 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 CA-C-N 119.87 1.835 . . . . 0.0 110.634 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.889 ' HB3' HD11 ' A' ' 53' ' ' ILE . 1.7 t -105.75 141.19 37.61 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.26 -0.9 . . . . 0.0 108.829 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.631 ' HB3' HG21 ' A' ' 25' ' ' ILE . 3.2 ptp180 -122.21 144.66 48.83 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.154 -0.966 . . . . 0.0 111.408 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 7' ' ' CYS . 17.6 mt -107.16 137.51 37.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.339 -0.851 . . . . 0.0 109.412 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.446 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.32 128.2 9.39 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.164 -1.575 . . . . 0.0 109.164 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 30.0 tttt -112.23 117.53 32.79 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.192 -1.181 . . . . 0.0 109.973 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.8 t -100.55 109.04 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.072 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.3 t -120.79 124.38 27.54 Favored Pre-proline 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 109.773 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.85 142.58 35.47 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 O-C-N 123.146 1.077 . . . . 0.0 110.452 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -103.47 154.23 37.98 Favored Pre-proline 0 N--CA 1.499 2.003 0 O-C-N 121.16 -0.963 . . . . 0.0 110.216 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.8 70.11 4.38 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.434 1.228 . . . . 0.0 110.463 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -152.9 -58.37 0.14 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.09 -1.006 . . . . 0.0 110.418 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.5 156.84 21.93 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.201 -0.937 . . . . 0.0 110.079 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -101.31 -48.02 4.51 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.141 -0.975 . . . . 0.0 110.31 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 61.3 p -88.86 -39.88 13.52 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.15 -0.969 . . . . 0.0 110.268 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -111.57 65.89 0.25 Allowed Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.65 72.63 0.36 Allowed Glycine 0 N--CA 1.495 2.609 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -146.09 135.11 22.63 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.16 -1.2 . . . . 0.0 110.351 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.5 mtp -117.62 141.52 48.28 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.194 -0.941 . . . . 0.0 110.366 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -130.42 127.71 39.86 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.132 -0.98 . . . . 0.0 110.25 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.92 153.57 42.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.122 -0.986 . . . . 0.0 110.088 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 56.6 m95 -105.98 129.6 54.07 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.194 -0.941 . . . . 0.0 109.949 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -112.41 177.11 4.75 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.21 -0.931 . . . . 0.0 111.162 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.447 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -94.69 -170.68 2.29 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.519 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.98 HG22 ' CE1' ' A' ' 93' ' ' HIS . 46.3 mm -88.3 -43.6 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.044 -1.035 . . . . 0.0 108.982 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -21.95 27.27 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.993 -1.067 . . . . 0.0 111.399 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 63.0 m -75.38 -43.68 48.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.683 -1.261 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.2 tpt -73.59 -39.33 64.7 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.733 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.666 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 10.1 m-85 -73.32 -30.21 63.21 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.967 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.42 -36.83 82.03 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.927 -1.108 . . . . 0.0 109.403 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -58.5 -38.64 78.09 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.991 -1.068 . . . . 0.0 109.888 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.2 -41.33 86.0 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.746 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -67.01 -33.58 75.87 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.3 -0.875 . . . . 0.0 110.647 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 18.2 ttt85 -86.5 -35.88 19.34 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.12 -0.988 . . . . 0.0 110.42 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -113.3 127.98 56.32 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.045 -1.034 . . . . 0.0 110.061 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.6 mtt85 -112.57 101.24 9.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.162 -0.961 . . . . 0.0 110.249 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -90.38 4.06 51.98 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.267 -0.895 . . . . 0.0 111.881 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.6 m 56.02 36.34 27.19 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.467 -1.396 . . . . 0.0 110.349 -179.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 58.8 m -117.56 161.72 19.17 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.199 -0.938 . . . . 0.0 109.92 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 tppt? -97.37 95.02 7.4 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.213 -0.929 . . . . 0.0 109.976 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -123.54 135.04 53.8 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.239 -0.913 . . . . 0.0 110.143 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.778 HG12 HD11 ' A' ' 76' ' ' LEU . 77.5 mt 52.84 94.71 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.048 -1.033 . . . . 0.0 110.589 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -115.22 135.4 54.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.966 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 53.46 -165.25 0.08 Allowed 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.1 -1.0 . . . . 0.0 110.542 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.551 HD13 ' HB ' ' A' ' 91' ' ' THR . 8.3 tt -103.68 -48.12 4.04 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.171 -0.955 . . . . 0.0 110.354 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.31 69.62 4.54 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.125 -0.985 . . . . 0.0 109.817 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -143.49 -58.6 0.41 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.267 -0.896 . . . . 0.0 110.07 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.778 HD11 HG12 ' A' ' 70' ' ' ILE . 94.3 mt -62.52 151.59 37.12 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.163 -0.961 . . . . 0.0 109.564 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -79.94 128.84 33.95 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.184 -0.948 . . . . 0.0 110.262 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 143.71 -47.62 0.78 Allowed Glycine 0 N--CA 1.494 2.505 0 C-N-CA 119.753 -1.213 . . . . 0.0 110.588 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.45 ' HA ' HD12 ' A' ' 82' ' ' LEU . 45.9 p-90 -51.7 -30.54 22.51 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.917 -1.343 . . . . 0.0 111.216 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 5.8 tp10 -53.76 -27.91 31.45 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.963 -1.086 . . . . 0.0 111.332 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -111.74 26.95 10.11 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.821 -1.174 . . . . 0.0 112.064 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.622 HD13 ' CD2' ' A' ' 10' ' ' TYR . 29.9 mt -108.81 -164.27 0.93 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.812 -1.18 . . . . 0.0 109.555 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -94.98 161.89 13.96 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.957 -1.09 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -76.36 -47.9 21.79 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.238 -0.914 . . . . 0.0 109.999 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.3 -41.65 93.88 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.236 -0.915 . . . . 0.0 109.594 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 15.3 mt-10 -59.46 -39.98 85.4 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.291 -0.881 . . . . 0.0 109.628 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.871 ' HA ' HD12 ' A' ' 90' ' ' ILE . 3.6 ttpp -56.39 -39.23 72.63 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.207 -0.933 . . . . 0.0 109.97 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.536 ' O ' HG22 ' A' ' 91' ' ' THR . 3.1 tt0 -57.88 -37.92 74.82 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.263 -0.898 . . . . 0.0 109.961 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -70.07 -33.72 72.28 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.122 -0.986 . . . . 0.0 110.031 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 87' ' ' LYS . 11.9 mt -70.37 -38.64 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.11 -0.994 . . . . 0.0 110.003 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.551 ' HB ' HD13 ' A' ' 73' ' ' LEU . 9.5 t -69.04 -32.42 71.9 Favored 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 118.913 -1.115 . . . . 0.0 110.276 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.58 -39.89 70.29 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.992 -1.067 . . . . 0.0 108.781 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.98 ' CE1' HG22 ' A' ' 53' ' ' ILE . 70.0 t60 -56.27 -43.79 79.12 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.268 -0.895 . . . . 0.0 109.721 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.468 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 58.0 mt -67.94 -39.68 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.905 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.43 85.12 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.16 -0.963 . . . . 0.0 109.681 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.35 -42.29 95.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.16 -0.963 . . . . 0.0 109.377 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.4 HD22 ' HD1' ' A' ' 57' ' ' PHE . 5.6 tp -66.07 -35.86 81.65 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.297 -0.877 . . . . 0.0 109.859 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 73.6 m -105.09 58.6 0.68 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.156 -0.965 . . . . 0.0 109.971 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t -129.91 62.41 1.55 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.091 -1.006 . . . . 0.0 110.283 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -143.32 40.06 1.45 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.098 -1.001 . . . . 0.0 110.232 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.58 41.9 1.59 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.2 -0.938 . . . . 0.0 110.215 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.55 120.14 11.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.179 -0.95 . . . . 0.0 110.283 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 63.48 173.66 2.62 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.1 m -136.21 85.31 27.7 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.197 -1.178 . . . . 0.0 110.201 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.43 171.19 17.55 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 O-C-N 123.351 1.185 . . . . 0.0 110.433 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.5 mtmt -117.55 -57.27 2.14 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.227 -0.921 . . . . 0.0 110.222 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.5 mmtm -117.42 134.53 54.73 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.246 -0.909 . . . . 0.0 110.273 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.34 60.47 1.7 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.173 -0.954 . . . . 0.0 110.247 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.68 138.36 51.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.139 -0.976 . . . . 0.0 110.204 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.64 148.49 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.235 -0.916 . . . . 0.0 110.206 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.3 t -113.96 130.3 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.235 -0.915 . . . . 0.0 110.021 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -117.45 135.09 54.14 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.155 -0.966 . . . . 0.0 110.272 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.34 129.26 55.76 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.16 -0.962 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -117.31 136.74 52.91 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.231 -0.918 . . . . 0.0 110.218 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 tp -117.96 144.88 45.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.214 -0.928 . . . . 0.0 110.248 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 35.3 p -117.89 109.48 16.58 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.177 -0.952 . . . . 0.0 110.195 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.7 m . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.192 179.975 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 ttm . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.19 40.25 2.88 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.163 -0.961 . . . . 0.0 110.238 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -144.65 136.44 25.79 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.156 -0.965 . . . . 0.0 110.341 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -144.96 151.69 39.03 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.21 -0.932 . . . . 0.0 110.322 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -139.69 131.85 28.09 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.235 -0.916 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.808 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.1 m-85 -125.4 139.95 53.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.166 -0.959 . . . . 0.0 110.25 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.5 m -127.39 163.19 24.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.921 . . . . 0.0 108.871 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.643 HG12 HG23 ' A' ' 32' ' ' ILE . 29.2 m -133.76 133.29 56.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.95 -1.094 . . . . 0.0 110.753 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -139.3 155.28 47.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.307 -0.871 . . . . 0.0 109.989 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -102.11 143.15 32.29 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.31 -0.869 . . . . 0.0 109.884 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.31 138.38 56.47 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.156 -0.965 . . . . 0.0 110.146 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mttt -130.05 -59.8 1.04 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 110.334 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.01 93.31 2.38 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.199 -0.938 . . . . 0.0 110.422 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.9 142.97 4.23 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.525 HG22 ' HA ' ' A' ' 26' ' ' VAL . 29.8 p -114.69 147.01 40.24 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.259 -1.142 . . . . 0.0 109.921 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.62 147.79 38.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.089 -1.007 . . . . 0.0 111.003 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.94 124.88 18.23 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.1 t -61.36 131.05 49.03 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.221 -1.164 . . . . 0.0 109.344 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm -62.22 148.17 45.57 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.156 -0.965 . . . . 0.0 109.269 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttt 52.45 47.42 24.75 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.972 -1.08 . . . . 0.0 109.673 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.3 t -164.8 153.03 12.06 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.31 -0.869 . . . . 0.0 110.895 -178.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 tttm -103.84 46.96 0.89 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -142.05 -174.37 4.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.404 -0.81 . . . . 0.0 110.197 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -133.2 156.27 47.82 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.222 -0.924 . . . . 0.0 109.727 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.731 HG21 ' HD3' ' A' ' 31' ' ' ARG . 62.2 mt -96.35 113.04 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.81 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.525 ' HA ' HG22 ' A' ' 15' ' ' THR . 67.9 t -108.51 162.78 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -41.44 133.15 2.59 Favored 'General case' 0 N--CA 1.519 3.02 0 O-C-N 121.689 -0.632 . . . . 0.0 111.527 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.8 4.31 45.61 Favored Glycine 0 N--CA 1.493 2.453 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.084 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.424 ' CG1' HG23 ' A' ' 25' ' ' ILE . 89.3 t -115.11 134.79 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-N 119.582 1.691 . . . . 0.0 109.546 179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.706 ' HB3' HD11 ' A' ' 53' ' ' ILE . 44.9 t -85.39 134.41 34.08 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.169 -0.957 . . . . 0.0 108.933 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.731 ' HD3' HG21 ' A' ' 25' ' ' ILE . 46.1 mtm105 -115.43 135.48 54.07 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.177 -0.952 . . . . 0.0 111.275 -178.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.643 HG23 HG12 ' A' ' 8' ' ' VAL . 12.9 mt -104.7 129.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 178.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.1 131.71 10.7 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 22.7 tttt -110.78 113.45 26.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.327 -1.102 . . . . 0.0 109.566 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.73 107.62 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.148 -0.97 . . . . 0.0 110.198 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.407 HG13 ' O ' ' A' ' 36' ' ' VAL . 7.2 p -124.08 127.17 25.45 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.282 -0.886 . . . . 0.0 110.193 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.63 139.05 27.62 Favored 'Trans proline' 0 C--N 1.319 -0.983 0 O-C-N 123.088 1.046 . . . . 0.0 110.514 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -103.44 118.74 56.94 Favored Pre-proline 0 N--CA 1.5 2.061 0 O-C-N 121.285 -0.885 . . . . 0.0 109.95 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -73.1 80.13 1.91 Allowed 'Trans proline' 0 N--CA 1.486 1.036 0 O-C-N 123.078 1.041 . . . . 0.0 110.588 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -149.95 -58.69 0.19 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.238 -0.914 . . . . 0.0 110.433 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.92 156.67 20.85 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.189 -0.944 . . . . 0.0 110.18 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -97.8 -39.84 8.83 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.216 -0.927 . . . . 0.0 110.634 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.7 m -55.71 -38.68 70.04 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 120.987 -1.071 . . . . 0.0 110.395 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.81 -175.92 25.02 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -141.37 -95.71 0.26 Allowed Glycine 0 N--CA 1.493 2.499 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -130.82 146.59 52.31 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.193 -1.18 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.2 ttm -115.66 149.08 38.93 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.191 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -129.23 148.75 51.2 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.552 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.47 155.28 48.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.57 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 71.0 m95 -98.13 156.87 16.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.122 -0.986 . . . . 0.0 110.157 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -136.15 172.99 12.2 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.317 -0.864 . . . . 0.0 110.546 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 0.3 OUTLIER -91.72 -170.42 2.58 Favored 'General case' 0 N--CA 1.504 2.232 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.585 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.706 HD11 ' HB3' ' A' ' 30' ' ' CYS . 42.1 mm -83.89 -60.02 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.161 179.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 23.7 mmtt -73.82 -27.42 61.11 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.927 -1.108 . . . . 0.0 111.262 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 52' ' ' HIS . 84.5 m -65.87 -51.47 58.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 120.741 -1.224 . . . . 0.0 110.253 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.671 ' HE1' HD11 ' A' ' 70' ' ' ILE . 0.6 OUTLIER -70.05 -39.55 75.65 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.814 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.458 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 8.6 m-85 -71.85 -28.56 63.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.2 -1.0 . . . . 0.0 109.944 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -67.38 -37.01 82.48 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.789 -1.194 . . . . 0.0 109.43 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -58.58 -40.49 83.29 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.023 -1.048 . . . . 0.0 109.755 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.22 -42.17 98.14 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.227 -0.921 . . . . 0.0 109.129 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -56.71 -33.83 66.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.152 -0.968 . . . . 0.0 109.67 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.8 mtt-85 -103.35 29.84 5.34 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.215 -0.928 . . . . 0.0 110.497 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.0 168.61 9.3 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.882 -1.136 . . . . 0.0 109.976 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -63.1 152.14 38.03 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.164 -0.96 . . . . 0.0 110.096 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.96 -33.76 19.54 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.188 -0.945 . . . . 0.0 110.742 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 p -49.73 -34.72 19.73 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 120.931 -1.106 . . . . 0.0 111.187 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -109.6 139.92 44.03 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.037 -1.039 . . . . 0.0 110.164 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -114.94 144.41 43.62 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.225 -0.922 . . . . 0.0 110.136 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -123.24 136.71 54.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.204 -0.935 . . . . 0.0 110.461 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.671 HD11 ' HE1' ' A' ' 56' ' ' MET . 83.4 mt 54.54 101.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.949 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -110.23 141.17 43.55 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.158 -0.964 . . . . 0.0 109.789 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.6 t0 53.41 -169.9 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.035 -1.041 . . . . 0.0 110.416 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.536 ' HB2' HG23 ' A' ' 91' ' ' THR . 18.7 tp -118.52 38.58 3.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.105 -0.997 . . . . 0.0 110.648 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 35.98 0.82 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.132 -0.98 . . . . 0.0 110.55 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -131.43 29.45 4.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.201 -0.937 . . . . 0.0 110.559 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.808 HD22 ' HB3' ' A' ' 6' ' ' PHE . 96.4 mt -137.46 153.57 50.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.045 -1.034 . . . . 0.0 109.401 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.8 102.24 11.47 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.07 -1.018 . . . . 0.0 110.393 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.93 -39.11 0.6 Allowed Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.674 -1.25 . . . . 0.0 111.105 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.403 ' N ' ' CG2' ' A' ' 8' ' ' VAL . 46.6 p-90 -57.26 -32.17 66.32 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.832 -1.393 . . . . 0.0 110.913 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -53.26 -34.27 56.5 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.832 -1.167 . . . . 0.0 110.612 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.86 -36.06 31.89 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.999 -1.063 . . . . 0.0 110.295 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.02 176.91 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.965 -1.084 . . . . 0.0 110.66 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -104.02 160.4 14.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.078 -1.014 . . . . 0.0 110.406 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -60.44 -46.01 91.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.238 -0.914 . . . . 0.0 110.086 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -61.56 -48.04 82.79 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.553 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -64.66 -40.59 95.69 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.429 -0.909 . . . . 0.0 109.197 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.408 ' O ' ' OG1' ' A' ' 91' ' ' THR . 12.5 tttm -62.3 -38.9 91.17 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.347 -0.846 . . . . 0.0 109.911 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.07 -41.12 97.84 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.196 -0.94 . . . . 0.0 109.893 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -66.89 -38.04 85.53 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.244 -0.91 . . . . 0.0 110.081 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.14 -38.5 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.124 -0.985 . . . . 0.0 109.338 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.536 HG23 ' HB2' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -59.24 -39.03 81.47 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.135 -0.978 . . . . 0.0 109.811 179.472 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -56.02 -36.76 68.33 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.063 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.681 ' CE1' HG22 ' A' ' 53' ' ' ILE . 0.3 OUTLIER -58.82 -51.61 69.26 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.677 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.458 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.2 mt -60.79 -37.59 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.225 -0.922 . . . . 0.0 109.704 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.09 86.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.168 -0.957 . . . . 0.0 109.62 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.37 -43.35 77.56 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.232 -0.917 . . . . 0.0 108.791 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.73 -35.06 79.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.315 -0.865 . . . . 0.0 109.77 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.3 m -100.62 66.59 1.23 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.981 -1.074 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.3 t -138.34 165.89 25.61 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.126 -0.984 . . . . 0.0 110.177 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -138.94 -175.74 4.25 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.279 -0.888 . . . . 0.0 110.15 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.05 112.12 18.31 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.167 -0.958 . . . . 0.0 110.242 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.92 48.07 1.81 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.297 -0.877 . . . . 0.0 110.226 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -103.3 -146.41 16.82 Favored Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.496 -1.441 . . . . 0.0 109.496 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 36.1 m -130.8 95.75 25.05 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.233 -1.157 . . . . 0.0 110.185 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.8 161.4 43.89 Favored 'Trans proline' 0 C--N 1.317 -1.102 0 O-C-N 123.378 1.199 . . . . 0.0 110.41 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.1 tttp 52.56 94.65 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.03 -1.044 . . . . 0.0 110.758 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -120.9 147.37 45.51 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.212 -0.93 . . . . 0.0 110.284 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.4 mtpp -124.13 145.22 49.42 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.168 -0.958 . . . . 0.0 110.201 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -120.63 166.99 12.9 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.186 -0.946 . . . . 0.0 110.198 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.9 t -116.63 101.44 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.225 -0.922 . . . . 0.0 109.986 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.9 t -122.53 109.56 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.321 -0.862 . . . . 0.0 110.0 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -118.53 128.59 54.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.181 -0.949 . . . . 0.0 110.137 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -133.87 127.2 32.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.185 -0.947 . . . . 0.0 110.294 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 pttt -126.05 150.72 47.94 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.178 -0.951 . . . . 0.0 110.294 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.9 tp -126.9 150.63 49.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.189 -0.944 . . . . 0.0 110.142 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.72 138.98 52.28 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.253 -0.905 . . . . 0.0 110.191 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.406 ' OXT' HG22 ' A' ' 117' ' ' THR . 5.8 m . . . . . 0 N--CA 1.502 2.172 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.733 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.4 mtp . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.95 161.41 20.93 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.221 -0.924 . . . . 0.0 110.316 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -124.38 127.43 47.55 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.228 -0.92 . . . . 0.0 110.089 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -133.72 159.48 40.44 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.153 -0.967 . . . . 0.0 110.337 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.2 137.86 31.08 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.217 -0.927 . . . . 0.0 110.191 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.718 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -117.25 142.13 47.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.9 m -130.51 165.0 23.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.262 -0.899 . . . . 0.0 109.314 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.8 m -130.64 139.83 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.066 -1.022 . . . . 0.0 110.641 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.02 107.66 4.12 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.239 -0.913 . . . . 0.0 110.35 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.791 ' CD2' HD13 ' A' ' 82' ' ' LEU . 10.5 m-85 -58.9 153.03 18.13 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.162 -0.961 . . . . 0.0 110.054 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.75 136.55 48.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.309 -0.869 . . . . 0.0 110.311 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -120.16 -57.34 1.94 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.253 -0.904 . . . . 0.0 110.306 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -128.24 122.99 33.06 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.097 -1.002 . . . . 0.0 110.161 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.98 170.88 11.96 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.815 HG23 ' CG1' ' A' ' 26' ' ' VAL . 57.4 m -140.98 135.44 31.17 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.18 -1.188 . . . . 0.0 110.126 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.44 137.17 26.8 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.16 -0.963 . . . . 0.0 110.734 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.6 123.21 15.73 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.6 t -62.37 130.9 47.39 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.246 -1.15 . . . . 0.0 109.46 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -62.41 147.33 48.89 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.117 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? 52.5 48.21 23.06 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.02 -1.05 . . . . 0.0 109.579 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -164.93 153.3 12.04 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.401 -0.812 . . . . 0.0 110.852 -178.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -104.05 46.27 0.92 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -143.28 -174.63 4.26 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.498 -0.751 . . . . 0.0 110.077 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -136.16 155.5 50.06 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.112 -0.993 . . . . 0.0 109.727 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.604 HG23 HG11 ' A' ' 29' ' ' VAL . 59.5 mt -103.86 118.29 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.303 -0.873 . . . . 0.0 109.709 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.815 ' CG1' HG23 ' A' ' 15' ' ' THR . 29.7 m -137.48 89.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.106 -0.996 . . . . 0.0 111.251 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 tttm 60.3 149.45 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.081 -1.012 . . . . 0.0 111.318 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.13 9.18 80.25 Favored Glycine 0 N--CA 1.496 2.678 0 C-N-CA 120.245 -0.978 . . . . 0.0 111.712 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.604 HG11 HG23 ' A' ' 25' ' ' ILE . 80.1 t -127.6 135.17 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-N 119.712 1.756 . . . . 0.0 110.247 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.781 ' HB3' HD11 ' A' ' 53' ' ' ILE . 5.7 t -87.47 120.96 29.3 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.592 ' HD3' HG21 ' A' ' 25' ' ' ILE . 44.6 mtm180 -101.69 129.8 47.93 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.939 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.442 HD12 ' HG2' ' A' ' 56' ' ' MET . 18.9 mt -103.82 131.06 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.13 126.0 8.77 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.419 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 40.4 tttt -107.48 116.99 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.289 -1.124 . . . . 0.0 109.741 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.87 111.96 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.097 -1.002 . . . . 0.0 110.106 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 73.7 t -120.37 113.64 33.63 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.247 -0.908 . . . . 0.0 109.794 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.35 147.24 46.76 Favored 'Trans proline' 0 N--CA 1.485 1.018 0 O-C-N 123.202 1.106 . . . . 0.0 110.47 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -102.89 163.7 17.02 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.327 -0.858 . . . . 0.0 110.233 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.28 70.92 3.08 Favored 'Trans proline' 0 C--N 1.317 -1.085 0 O-C-N 123.357 1.188 . . . . 0.0 110.411 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -152.61 -58.27 0.14 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.127 -0.983 . . . . 0.0 110.428 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 30.4 t -108.97 157.52 18.57 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.264 -0.898 . . . . 0.0 110.173 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -99.48 -45.03 5.96 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.165 -0.959 . . . . 0.0 110.409 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.14 -40.39 13.79 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.13 -0.981 . . . . 0.0 110.032 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.58 -167.8 19.32 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.47 41.7 5.37 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -122.02 143.29 49.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.198 -1.177 . . . . 0.0 110.271 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -117.15 129.66 56.11 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.244 -0.91 . . . . 0.0 110.26 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -122.99 136.0 54.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -139.76 155.8 47.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.131 -0.981 . . . . 0.0 109.923 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 51.8 m95 -98.11 163.01 12.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.185 -0.947 . . . . 0.0 110.138 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -143.66 172.69 12.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.265 -0.897 . . . . 0.0 110.683 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 1.9 m80 -91.71 -172.07 3.09 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.954 HG22 ' CE1' ' A' ' 93' ' ' HIS . 44.6 mm -83.38 -47.1 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 C-N-CA 119.117 -1.033 . . . . 0.0 109.047 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.7 mtmt -80.22 -32.89 38.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.798 -1.189 . . . . 0.0 110.717 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 70.8 m -62.67 -50.92 69.28 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.939 -1.101 . . . . 0.0 110.235 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.442 ' HG2' HD12 ' A' ' 32' ' ' ILE . 10.0 tpt -68.0 -42.22 81.08 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.842 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.65 ' HD1' HD22 ' A' ' 97' ' ' LEU . 9.8 m-85 -69.27 -30.71 68.88 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.647 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.61 -37.82 85.36 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.962 -1.086 . . . . 0.0 109.417 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -58.18 -39.19 78.26 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.027 -1.046 . . . . 0.0 109.903 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.7 mp -58.1 -41.78 84.28 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.154 -0.966 . . . . 0.0 109.346 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -57.95 -34.12 69.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.236 -0.915 . . . . 0.0 109.589 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -104.4 30.46 5.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.196 -0.94 . . . . 0.0 110.525 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -107.68 168.34 9.32 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.892 -1.13 . . . . 0.0 110.071 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -78.92 157.36 28.24 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.247 -0.908 . . . . 0.0 110.178 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -83.67 -33.41 25.21 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.257 -0.902 . . . . 0.0 110.707 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.42 -36.2 32.0 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.924 -1.11 . . . . 0.0 110.873 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 m -109.8 148.29 31.73 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.133 -0.979 . . . . 0.0 109.883 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -116.39 139.54 50.32 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.161 -0.962 . . . . 0.0 110.478 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.69 130.41 56.32 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.178 -0.951 . . . . 0.0 109.918 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.576 HG23 HD11 ' A' ' 76' ' ' LEU . 73.4 mt 54.97 99.21 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 O-C-N 121.126 -0.984 . . . . 0.0 110.469 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -109.49 139.91 43.9 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.156 -0.965 . . . . 0.0 110.31 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.17 -176.73 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.092 -1.005 . . . . 0.0 110.896 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.871 HD11 HG23 ' A' ' 90' ' ' ILE . 15.0 tp -98.73 -29.65 12.89 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.25 42.88 1.08 Allowed 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.779 -1.201 . . . . 0.0 110.404 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -122.06 34.7 5.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.142 -0.974 . . . . 0.0 110.192 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 6' ' ' PHE . 57.3 mt -145.8 153.71 41.22 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.05 -1.031 . . . . 0.0 109.963 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -85.13 116.37 23.46 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.046 -1.034 . . . . 0.0 110.442 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 148.49 -40.92 0.9 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.744 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.403 ' HA ' HD12 ' A' ' 82' ' ' LEU . 48.9 p-90 -61.93 -26.1 67.98 Favored 'General case' 0 N--CA 1.513 2.684 0 O-C-N 121.069 -1.253 . . . . 0.0 111.538 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -53.05 -28.04 22.75 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 120.788 -1.195 . . . . 0.0 111.465 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -112.77 28.45 8.78 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.809 -1.182 . . . . 0.0 112.116 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.791 HD13 ' CD2' ' A' ' 10' ' ' TYR . 25.8 mt -109.76 -166.1 1.07 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.714 -1.242 . . . . 0.0 109.918 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -97.74 162.83 13.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.101 -0.999 . . . . 0.0 110.333 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -81.96 -39.89 23.02 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.212 -0.93 . . . . 0.0 110.306 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -61.85 -50.54 71.86 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.19 -0.944 . . . . 0.0 109.596 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 10.7 mt-10 -61.75 -41.49 97.73 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.289 -0.882 . . . . 0.0 109.227 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.562 ' O ' HG22 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -59.17 -34.36 72.02 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.259 -0.901 . . . . 0.0 110.208 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.71 -35.3 76.99 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.053 -1.029 . . . . 0.0 110.236 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.04 -41.32 77.81 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.969 -1.082 . . . . 0.0 110.201 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.871 HG23 HD11 ' A' ' 73' ' ' LEU . 4.5 tt -65.04 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.223 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.858 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -65.4 -40.01 92.92 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.846 -1.159 . . . . 0.0 109.317 178.924 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -35.33 63.56 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.277 -0.89 . . . . 0.0 110.247 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.954 ' CE1' HG22 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -56.8 -47.29 80.55 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 121.037 -1.04 . . . . 0.0 109.922 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.453 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 16.6 mt -63.63 -37.48 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.114 -0.991 . . . . 0.0 109.724 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.09 -39.56 95.08 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.144 -0.973 . . . . 0.0 109.664 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.13 -36.8 69.5 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.2 -0.937 . . . . 0.0 109.801 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.65 HD22 ' HD1' ' A' ' 57' ' ' PHE . 8.2 tp -79.76 -30.95 40.88 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.179 -0.951 . . . . 0.0 110.584 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 66.9 m -93.08 -38.14 11.78 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.835 -1.165 . . . . 0.0 110.349 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.66 91.72 3.77 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.127 -0.983 . . . . 0.0 110.157 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -123.72 161.95 24.11 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.17 -0.956 . . . . 0.0 110.151 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.58 159.88 30.99 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.184 -0.947 . . . . 0.0 110.197 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.2 113.59 8.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.157 -0.965 . . . . 0.0 110.195 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 108.36 -74.41 0.21 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 16.7 p -119.89 153.37 54.86 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.127 -1.219 . . . . 0.0 110.285 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.92 97.08 0.88 Allowed 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.384 1.202 . . . . 0.0 110.443 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -125.95 145.31 50.34 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.177 -0.952 . . . . 0.0 110.249 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -122.37 134.57 54.62 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.27 -0.894 . . . . 0.0 110.253 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.1 tptm -119.0 134.46 55.18 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.16 -0.963 . . . . 0.0 110.189 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.74 164.88 14.33 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.232 -0.918 . . . . 0.0 110.267 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.4 t -121.8 117.0 51.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.222 -0.924 . . . . 0.0 109.983 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 9.2 p -138.04 142.88 34.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.246 -0.909 . . . . 0.0 110.213 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -130.6 107.73 9.4 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.202 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -123.07 140.71 52.75 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.233 -0.917 . . . . 0.0 110.289 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -121.0 104.62 9.94 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.256 -0.903 . . . . 0.0 110.214 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.4 mt -126.45 139.01 53.58 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.175 -0.953 . . . . 0.0 110.211 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.9 p -123.43 111.81 16.79 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.178 -0.951 . . . . 0.0 110.222 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 10.8 m . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.242 179.971 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.6 mtm . . . . . 0 N--CA 1.491 1.625 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.88 79.19 1.64 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.156 -0.965 . . . . 0.0 110.309 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -118.03 -57.56 2.08 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.162 -0.961 . . . . 0.0 110.099 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -115.82 126.14 53.6 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.274 -0.892 . . . . 0.0 110.154 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -123.64 125.95 45.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.191 -0.943 . . . . 0.0 110.414 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.693 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -116.72 137.39 52.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.264 -0.898 . . . . 0.0 109.894 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.4 t -125.89 154.34 42.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 109.138 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.803 HG12 HG23 ' A' ' 32' ' ' ILE . 28.9 m -129.44 143.33 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.954 -1.091 . . . . 0.0 110.326 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -158.22 138.15 12.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.185 -0.947 . . . . 0.0 110.986 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.461 ' OH ' ' HB2' ' A' ' 86' ' ' GLU . 1.7 m-85 -53.53 155.73 2.86 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 121.093 -1.004 . . . . 0.0 110.424 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.479 ' CB ' HG22 ' A' ' 25' ' ' ILE . . . -88.17 150.98 23.01 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 119.535 -0.866 . . . . 0.0 109.652 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -105.05 -163.64 0.97 Allowed 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.16 -0.963 . . . . 0.0 110.337 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -89.51 61.24 5.48 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.159 -0.963 . . . . 0.0 110.037 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.764 ' O ' HG22 ' A' ' 26' ' ' VAL . . . -130.27 -164.88 11.45 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.315 -1.514 . . . . 0.0 109.315 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 p -117.94 110.81 18.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.299 -1.118 . . . . 0.0 110.012 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.51 99.35 5.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.129 -0.982 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.36 119.29 13.85 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.0 t -59.79 128.94 39.41 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.195 -1.18 . . . . 0.0 109.83 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -62.2 148.76 43.65 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.111 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt 52.71 45.05 29.45 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.991 -1.068 . . . . 0.0 109.647 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.4 t -164.74 153.45 12.6 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.35 -0.844 . . . . 0.0 110.742 -178.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.89 48.4 0.86 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.261 -0.899 . . . . 0.0 108.582 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -144.48 -174.65 4.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.467 -0.77 . . . . 0.0 110.286 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.85 157.08 44.95 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.186 -0.946 . . . . 0.0 109.871 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.733 HG23 ' HB ' ' A' ' 29' ' ' VAL . 38.3 mt -110.56 113.51 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 109.579 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.764 HG22 ' O ' ' A' ' 14' ' ' GLY . 62.1 t -134.33 90.19 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.06 -1.025 . . . . 0.0 110.569 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.87 134.6 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.348 -0.845 . . . . 0.0 111.194 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.96 -24.12 33.6 Favored Glycine 0 N--CA 1.495 2.601 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.19 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.733 ' HB ' HG23 ' A' ' 25' ' ' ILE . 57.9 t -114.38 136.95 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 CA-C-N 119.262 1.531 . . . . 0.0 110.373 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.27 139.5 39.84 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.4 -0.92 . . . . 0.0 108.851 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HG2' HG21 ' A' ' 25' ' ' ILE . 44.0 mtm-85 -107.82 137.28 46.1 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.109 -0.995 . . . . 0.0 110.811 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.803 HG23 HG12 ' A' ' 8' ' ' VAL . 4.5 mt -109.01 125.13 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.6 122.28 7.46 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.656 -1.377 . . . . 0.0 109.656 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.448 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.6 ttpm? -104.45 113.07 26.39 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.414 -1.05 . . . . 0.0 109.469 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.0 t -97.45 107.21 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.174 -0.954 . . . . 0.0 110.04 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.434 HG23 ' HD2' ' A' ' 37' ' ' PRO . 9.7 p -124.66 143.27 42.99 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.434 ' HD2' HG23 ' A' ' 36' ' ' VAL . 47.8 Cg_endo -74.03 151.55 44.82 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 O-C-N 123.209 1.11 . . . . 0.0 110.412 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -102.37 164.07 16.43 Favored Pre-proline 0 N--CA 1.5 2.034 0 O-C-N 121.303 -0.873 . . . . 0.0 110.102 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.5 -40.0 3.28 Favored 'Trans proline' 0 C--N 1.316 -1.177 0 O-C-N 123.404 1.213 . . . . 0.0 110.496 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -141.34 110.97 6.46 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.155 -0.966 . . . . 0.0 110.267 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.1 m -129.4 133.65 47.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.147 -0.971 . . . . 0.0 110.134 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -102.41 -47.25 4.54 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.266 -0.896 . . . . 0.0 110.65 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 p -88.49 -39.89 13.86 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.1 -1.0 . . . . 0.0 110.562 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -121.55 -163.57 12.0 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.87 -1.292 . . . . 0.0 109.87 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -140.79 -60.49 0.03 OUTLIER Glycine 0 N--CA 1.495 2.576 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -108.48 146.58 32.96 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.202 -1.175 . . . . 0.0 110.004 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.3 mtt -115.62 144.49 43.83 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.574 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -123.1 129.63 51.72 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.265 -0.897 . . . . 0.0 109.99 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -125.26 159.31 31.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.152 -0.968 . . . . 0.0 110.209 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.418 ' CE3' ' HB3' ' A' ' 31' ' ' ARG . 72.5 m95 -104.31 134.13 48.05 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.241 -0.912 . . . . 0.0 110.017 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -116.25 173.0 6.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.255 -0.903 . . . . 0.0 110.714 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.618 ' HD2' HG11 ' A' ' 29' ' ' VAL . 1.1 m170 -93.26 -171.79 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.986 HG22 ' CE1' ' A' ' 93' ' ' HIS . 49.3 mm -85.63 -45.0 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 C-N-CA 118.943 -1.103 . . . . 0.0 109.004 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -21.66 29.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.042 -1.037 . . . . 0.0 111.341 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 59.5 m -78.24 -41.69 33.5 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.753 -1.217 . . . . 0.0 109.759 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.35 -38.15 60.25 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.743 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.684 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 11.4 m-85 -71.76 -30.22 65.35 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.677 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -61.16 -37.01 81.36 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.921 -1.112 . . . . 0.0 109.497 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -58.87 -40.08 83.28 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.029 -1.044 . . . . 0.0 109.826 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.406 ' HB3' HD21 ' A' ' 97' ' ' LEU . 9.4 mp -58.96 -42.93 91.07 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.187 -0.946 . . . . 0.0 109.305 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -57.74 -34.14 69.2 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.296 -0.878 . . . . 0.0 109.68 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.05 29.68 5.75 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.212 -0.93 . . . . 0.0 110.589 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -111.41 167.4 10.33 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.882 -1.136 . . . . 0.0 109.971 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 37.8 mtt85 -71.07 157.21 38.59 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.164 -0.96 . . . . 0.0 110.095 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.32 -34.34 28.59 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.148 -0.97 . . . . 0.0 110.567 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.2 p -51.53 -35.73 41.96 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.926 -1.109 . . . . 0.0 110.833 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.4 p -110.6 126.87 54.92 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.085 -1.009 . . . . 0.0 110.17 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -116.85 144.22 44.76 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.168 -0.957 . . . . 0.0 110.117 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -125.29 150.43 47.11 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.221 -0.924 . . . . 0.0 110.27 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 76' ' ' LEU . 79.0 mt 53.6 96.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.162 -0.961 . . . . 0.0 110.76 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -115.69 133.06 56.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.135 -0.978 . . . . 0.0 109.936 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 51.49 -172.9 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.076 -1.015 . . . . 0.0 110.735 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.815 HD13 HG21 ' A' ' 90' ' ' ILE . 50.4 tp -117.19 84.33 2.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.134 -0.979 . . . . 0.0 110.397 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -171.91 -51.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.17 -0.956 . . . . 0.0 110.744 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -51.0 -30.87 16.34 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.113 -0.992 . . . . 0.0 111.23 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.693 HD22 ' HB3' ' A' ' 6' ' ' PHE . 30.8 mt -74.73 153.87 38.65 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.919 -1.113 . . . . 0.0 109.964 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -99.38 119.05 37.34 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.198 -0.939 . . . . 0.0 111.065 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.83 -38.81 1.46 Allowed Glycine 0 N--CA 1.495 2.567 0 N-CA-C 110.266 -1.133 . . . . 0.0 110.266 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.418 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 59.7 p-90 -51.39 -34.91 36.53 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.017 -1.284 . . . . 0.0 110.937 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.418 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 6.4 tt0 -54.79 -35.9 64.33 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.982 -1.074 . . . . 0.0 110.565 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -80.54 -36.8 32.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.034 -1.041 . . . . 0.0 110.286 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.49 HD23 ' HG3' ' A' ' 86' ' ' GLU . 7.2 mp -48.9 172.74 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.131 -0.98 . . . . 0.0 111.206 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -105.11 163.2 12.74 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.212 -0.93 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -52.42 -39.42 60.97 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.179 -0.95 . . . . 0.0 110.798 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.97 -52.13 65.28 Favored 'General case' 0 N--CA 1.508 2.455 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.635 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.49 ' HG3' HD23 ' A' ' 82' ' ' LEU . 14.0 tp10 -64.09 -40.97 97.38 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.435 -0.906 . . . . 0.0 109.065 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.539 ' HG3' HD21 ' A' ' 73' ' ' LEU . 33.3 tttt -63.99 -39.39 94.0 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.694 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.33 -40.73 97.31 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.58 -37.81 88.85 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.06 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.815 HG21 HD13 ' A' ' 73' ' ' LEU . 42.0 mm -64.86 -41.73 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 47.2 p -63.16 -47.08 84.19 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.426 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -64.25 -40.56 96.26 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.981 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.986 ' CE1' HG22 ' A' ' 53' ' ' ILE . 64.6 t60 -61.15 -43.55 98.7 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.435 HG12 ' CE2' ' A' ' 57' ' ' PHE . 19.1 mt -70.44 -38.72 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 O-C-N 121.159 -0.963 . . . . 0.0 108.839 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.09 91.29 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.137 -0.977 . . . . 0.0 109.375 178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.77 -37.0 80.38 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.165 -0.959 . . . . 0.0 109.829 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.561 HD22 ' HD2' ' A' ' 57' ' ' PHE . 5.0 tp -88.07 -33.33 18.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.401 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.3 m -102.17 54.51 0.8 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.945 -1.097 . . . . 0.0 110.206 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -132.69 117.93 18.47 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.178 -0.951 . . . . 0.0 110.22 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -119.61 101.17 7.73 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.178 -0.951 . . . . 0.0 110.188 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.91 114.32 7.91 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.135 -0.978 . . . . 0.0 110.28 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -121.19 77.51 1.32 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.231 -0.918 . . . . 0.0 110.232 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -139.85 161.95 26.29 Favored Glycine 0 N--CA 1.493 2.491 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 m -118.48 94.24 46.96 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.14 -1.212 . . . . 0.0 110.153 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.3 -172.48 0.9 Allowed 'Trans proline' 0 C--N 1.317 -1.102 0 O-C-N 123.357 1.188 . . . . 0.0 110.482 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -116.13 -56.18 2.33 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.161 -0.962 . . . . 0.0 110.282 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.81 -166.09 1.06 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.115 -0.99 . . . . 0.0 110.148 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -118.52 -64.6 1.27 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.216 -0.927 . . . . 0.0 110.131 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.59 136.6 53.17 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.233 -0.917 . . . . 0.0 110.222 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 61.5 t -130.06 142.61 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.271 -0.893 . . . . 0.0 109.898 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.0 t -117.62 138.59 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.161 -0.962 . . . . 0.0 109.956 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -127.31 149.1 50.19 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.293 -0.879 . . . . 0.0 110.299 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.36 138.46 51.78 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.244 -0.91 . . . . 0.0 110.193 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -122.68 129.79 52.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.225 -0.922 . . . . 0.0 110.17 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 13.6 tp -118.84 105.05 11.12 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.131 -0.981 . . . . 0.0 110.273 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.3 m -122.48 122.06 38.04 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.142 -0.973 . . . . 0.0 110.214 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.495 1.794 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.212 -179.932 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.79 0.328 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -129.44 77.14 1.77 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.14 -0.975 . . . . 0.0 110.233 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -133.47 92.64 3.02 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.173 -0.955 . . . . 0.0 110.106 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -118.23 150.8 38.83 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.179 -0.951 . . . . 0.0 110.281 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 mmt-85 -116.29 134.17 55.2 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.232 -0.917 . . . . 0.0 110.039 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.649 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.3 m-85 -116.99 144.99 43.94 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.169 -0.957 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.0 t -131.56 153.09 50.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.351 -0.843 . . . . 0.0 108.952 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.523 HG12 HG23 ' A' ' 32' ' ' ILE . 24.2 m -126.95 132.0 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 O-C-N 120.994 -1.066 . . . . 0.0 110.568 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -147.68 159.63 43.57 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.087 -1.008 . . . . 0.0 110.561 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.407 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -100.41 155.74 17.65 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.453 -0.78 . . . . 0.0 109.968 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.552 ' HB2' ' NE ' ' A' ' 31' ' ' ARG . . . -107.61 138.68 43.39 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.361 -0.837 . . . . 0.0 110.292 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 tttt -150.23 127.73 11.51 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.248 -0.907 . . . . 0.0 110.605 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 ttt85 54.71 99.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.093 -1.004 . . . . 0.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.869 ' O ' HG21 ' A' ' 26' ' ' VAL . . . 144.86 -151.41 23.55 Favored Glycine 0 N--CA 1.496 2.665 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.622 HG23 ' O ' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -158.02 138.44 12.72 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.195 -1.179 . . . . 0.0 110.593 -179.882 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.98 107.16 4.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.157 -0.964 . . . . 0.0 110.539 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.67 114.72 7.13 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.451 ' CB ' HD11 ' A' ' 25' ' ' ILE . 24.6 t -61.06 128.49 36.71 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.207 -1.172 . . . . 0.0 109.521 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.426 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 19.1 tptt -61.8 148.09 44.27 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.196 -0.94 . . . . 0.0 109.091 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.3 mttt 52.74 45.62 28.35 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.946 -1.096 . . . . 0.0 109.669 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.8 t -165.21 154.08 12.21 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.362 -0.836 . . . . 0.0 110.783 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -105.5 44.04 1.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -141.43 -177.11 4.99 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.015 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -126.71 161.68 27.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.019 -1.051 . . . . 0.0 110.264 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.93 HG23 ' CG1' ' A' ' 29' ' ' VAL . 7.1 mt -120.17 102.92 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.409 -0.807 . . . . 0.0 109.997 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.869 HG21 ' O ' ' A' ' 14' ' ' GLY . 9.5 p -162.32 143.93 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.24 -0.913 . . . . 0.0 111.266 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.9 tptp 52.84 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.261 -0.9 . . . . 0.0 111.558 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.51 9.31 83.59 Favored Glycine 0 N--CA 1.496 2.652 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.061 179.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.93 ' CG1' HG23 ' A' ' 25' ' ' ILE . 58.9 t -124.49 135.14 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 119.891 1.846 . . . . 0.0 110.582 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.637 ' HB3' HD11 ' A' ' 53' ' ' ILE . 43.4 t -102.0 140.01 36.87 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.301 -0.875 . . . . 0.0 108.767 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.842 ' HB3' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -129.23 150.33 50.65 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.124 -0.985 . . . . 0.0 111.401 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.523 HG23 HG12 ' A' ' 8' ' ' VAL . 19.2 mt -110.81 138.27 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.444 -0.785 . . . . 0.0 108.997 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.12 125.89 8.56 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.165 -1.574 . . . . 0.0 109.165 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.431 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 22.0 ttmt -107.51 120.54 42.47 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.238 -1.154 . . . . 0.0 109.804 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.5 t -101.63 107.5 21.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.058 -1.026 . . . . 0.0 110.28 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.444 HG23 ' HD2' ' A' ' 37' ' ' PRO . 8.4 p -124.66 143.5 43.66 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.444 ' HD2' HG23 ' A' ' 36' ' ' VAL . 46.6 Cg_endo -72.96 126.36 11.2 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 O-C-N 123.089 1.047 . . . . 0.0 110.228 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -105.1 117.79 57.66 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.165 -0.959 . . . . 0.0 110.231 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -74.84 70.0 5.27 Favored 'Trans proline' 0 N--CA 1.485 0.998 0 O-C-N 123.193 1.102 . . . . 0.0 110.313 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -148.17 -58.93 0.24 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.113 -0.992 . . . . 0.0 110.449 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 21.8 p -108.68 157.39 18.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.228 -0.92 . . . . 0.0 110.178 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -95.97 -39.62 9.68 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.228 -0.92 . . . . 0.0 110.41 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.9 t -58.28 -40.14 81.13 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.047 -1.033 . . . . 0.0 110.109 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -108.77 75.34 0.21 Allowed Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.371 -1.491 . . . . 0.0 109.371 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.76 -45.43 96.25 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -115.78 138.85 50.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.259 -1.142 . . . . 0.0 110.257 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.6 ttt -117.25 143.62 45.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.221 -0.924 . . . . 0.0 110.385 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -117.99 128.51 54.85 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.249 -0.907 . . . . 0.0 110.139 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -122.95 148.59 45.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.21 -0.931 . . . . 0.0 109.777 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 23.4 m95 -94.23 163.25 13.52 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.137 -0.977 . . . . 0.0 109.94 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.426 ' CE1' ' HB3' ' A' ' 19' ' ' LYS . 89.0 m-85 -146.29 174.82 11.01 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.307 -0.871 . . . . 0.0 110.459 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CD2' HG12 ' A' ' 25' ' ' ILE . 1.8 m80 -99.44 -175.79 3.1 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.331 -0.855 . . . . 0.0 108.831 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.929 HG22 ' CE1' ' A' ' 93' ' ' HIS . 49.8 mm -83.98 -34.34 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 O-C-N 121.076 -1.015 . . . . 0.0 109.582 178.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -91.38 -32.45 15.65 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.695 -1.253 . . . . 0.0 110.594 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 70.9 m -63.46 -52.38 61.65 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.959 -1.088 . . . . 0.0 110.744 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.411 ' HB2' ' HB3' ' A' ' 51' ' ' TYR . 11.7 tpt -67.76 -38.27 83.23 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.42 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 13.2 m-85 -76.77 -27.0 55.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.015 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -75.21 -37.12 61.27 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.836 -1.165 . . . . 0.0 109.407 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -40.85 82.32 Favored 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.31 179.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.854 HD23 HD21 ' A' ' 97' ' ' LEU . 3.8 tp -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.405 -0.809 . . . . 0.0 109.606 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -70.31 -33.32 71.38 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.181 -0.949 . . . . 0.0 110.424 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -30.62 21.31 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.11 -0.994 . . . . 0.0 111.059 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -107.88 99.82 9.24 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.877 -1.139 . . . . 0.0 110.434 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -121.34 104.45 9.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.288 -0.883 . . . . 0.0 109.802 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.691 ' O ' HG23 ' A' ' 66' ' ' THR . . . -87.3 -37.23 17.35 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.166 -0.959 . . . . 0.0 110.685 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -172.38 -51.91 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.145 -0.972 . . . . 0.0 111.035 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.43 160.81 17.38 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.157 -0.964 . . . . 0.0 110.475 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -99.34 146.87 25.8 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.26 -0.9 . . . . 0.0 110.019 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -101.15 160.1 14.68 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.2 -0.937 . . . . 0.0 110.305 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.7 mt 55.69 99.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.179 -0.951 . . . . 0.0 110.538 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.55 143.62 44.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.205 -0.934 . . . . 0.0 110.001 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.26 -172.33 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.093 -1.005 . . . . 0.0 110.423 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.958 HD22 HG23 ' A' ' 91' ' ' THR . 13.2 tp -122.54 37.38 4.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.218 -0.926 . . . . 0.0 110.71 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -144.42 36.56 1.21 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.085 -1.01 . . . . 0.0 110.404 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -134.98 33.53 3.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.245 -0.909 . . . . 0.0 110.101 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.649 HD22 ' HB3' ' A' ' 6' ' ' PHE . 55.2 mt -138.91 156.36 47.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.093 -1.004 . . . . 0.0 109.729 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -86.55 104.66 16.2 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.167 -0.958 . . . . 0.0 110.875 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.97 -30.12 2.28 Favored Glycine 0 N--CA 1.495 2.604 0 C-N-CA 119.519 -1.324 . . . . 0.0 111.806 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.424 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 19.0 p-90 -57.65 -34.23 69.13 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 119.492 1.646 . . . . 0.0 110.761 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.424 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 23.5 tt0 -55.78 -35.61 66.46 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.943 -1.098 . . . . 0.0 110.487 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -74.49 -32.77 62.65 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.03 -1.044 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.8 174.44 0.02 OUTLIER 'General case' 0 N--CA 1.519 2.979 0 O-C-N 120.971 -1.081 . . . . 0.0 110.913 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -105.43 161.77 14.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.175 -0.953 . . . . 0.0 110.452 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.54 -50.12 74.91 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.226 -0.921 . . . . 0.0 110.347 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -61.18 -37.2 82.06 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.238 -0.914 . . . . 0.0 110.203 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 55.4 mt-10 -73.27 -41.22 63.88 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.132 -0.98 . . . . 0.0 108.805 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.478 ' O ' HG22 ' A' ' 90' ' ' ILE . 34.7 tttt -58.89 -34.86 72.13 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.372 -0.83 . . . . 0.0 109.949 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -65.13 -35.6 81.62 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.091 -1.006 . . . . 0.0 109.987 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -67.51 -47.31 70.33 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.981 -1.074 . . . . 0.0 110.083 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.478 HG22 ' O ' ' A' ' 87' ' ' LYS . 18.2 tt -63.98 -34.43 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.437 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.823 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.958 HG23 HD22 ' A' ' 73' ' ' LEU . 0.8 OUTLIER -63.35 -39.38 94.39 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.912 -1.117 . . . . 0.0 109.179 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -55.77 -38.63 70.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.141 -0.974 . . . . 0.0 109.969 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.929 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.4 m-70 -60.69 -53.33 58.69 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.196 -0.94 . . . . 0.0 109.837 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.449 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.6 mt -61.94 -38.73 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.484 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.24 93.18 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.156 -0.965 . . . . 0.0 109.508 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.53 -43.4 76.82 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.234 -0.916 . . . . 0.0 108.797 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.854 HD21 HD23 ' A' ' 60' ' ' LEU . 13.6 tp -60.56 -34.97 74.94 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.282 -0.886 . . . . 0.0 109.962 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.7 m -98.14 50.91 1.02 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.088 -1.007 . . . . 0.0 110.116 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.428 ' OG ' ' N ' ' A' ' 100' ' ' LYS . 9.5 t -118.55 -171.76 2.15 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.125 -0.985 . . . . 0.0 110.056 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.428 ' N ' ' OG ' ' A' ' 99' ' ' SER . 10.2 mttp -134.41 40.37 3.0 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.162 -0.961 . . . . 0.0 110.211 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -143.34 130.15 20.42 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.286 -0.884 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.53 42.91 1.62 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.193 -0.942 . . . . 0.0 110.346 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 105.42 -71.83 0.23 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 18.7 p -117.68 157.74 47.15 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.282 -1.128 . . . . 0.0 110.28 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.54 122.2 8.07 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.394 1.207 . . . . 0.0 110.361 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.8 mttp -120.57 41.16 3.32 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.237 -0.914 . . . . 0.0 110.154 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 17.7 tttp 52.68 71.66 0.46 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.06 -1.025 . . . . 0.0 110.751 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm -119.76 81.64 1.76 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.126 -0.984 . . . . 0.0 110.218 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -127.84 111.0 13.14 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.206 -0.934 . . . . 0.0 110.222 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.5 t -115.3 100.42 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.189 -0.945 . . . . 0.0 109.918 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.3 t -126.14 143.43 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.193 -0.942 . . . . 0.0 109.957 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -114.57 87.94 2.75 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.273 -0.892 . . . . 0.0 110.166 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.47 140.44 52.77 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.222 -0.924 . . . . 0.0 110.243 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.8 ttpt -117.09 107.1 14.09 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.192 -0.943 . . . . 0.0 110.224 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.5 tt -125.88 108.76 11.76 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.272 -0.892 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.7 m -121.53 147.43 45.81 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.202 -0.936 . . . . 0.0 110.228 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.2 p . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.233 179.945 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 ttt . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.98 130.91 53.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.282 -0.886 . . . . 0.0 110.282 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -127.96 -66.02 0.88 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.165 -0.959 . . . . 0.0 110.253 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -152.04 134.66 15.41 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.176 -0.952 . . . . 0.0 110.606 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -125.08 143.99 50.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.208 -0.933 . . . . 0.0 110.165 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.539 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.7 m-85 -118.78 149.57 41.27 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.289 -0.882 . . . . 0.0 110.209 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.437 ' O ' HG23 ' A' ' 32' ' ' ILE . 10.4 m -135.41 164.81 26.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.254 -0.904 . . . . 0.0 109.421 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.466 ' HB ' HD23 ' A' ' 76' ' ' LEU . 3.9 p -139.29 112.87 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.053 -1.03 . . . . 0.0 110.231 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -125.77 142.97 51.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 109.699 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.454 ' CD1' ' HB3' ' A' ' 82' ' ' LEU . 95.9 m-85 -99.6 137.75 37.65 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.229 -0.919 . . . . 0.0 109.667 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.58 134.66 46.72 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.043 -1.036 . . . . 0.0 110.742 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 32.4 tttt -119.63 -58.02 1.93 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.239 -0.913 . . . . 0.0 110.014 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -147.82 38.61 0.92 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.219 -0.925 . . . . 0.0 110.513 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -146.92 157.56 27.45 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.471 HG22 ' HA ' ' A' ' 26' ' ' VAL . 75.4 p -140.53 140.73 35.28 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.21 -1.171 . . . . 0.0 110.205 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -161.0 151.12 17.56 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.206 -0.934 . . . . 0.0 111.398 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -54.46 127.02 38.74 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 108.822 -1.711 . . . . 0.0 108.822 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.48 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 23.4 p -64.53 127.9 33.49 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.272 -1.134 . . . . 0.0 110.826 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 1.2 mptm? -75.82 156.51 34.39 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.52 -0.738 . . . . 0.0 109.308 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 tptp 65.89 16.25 10.4 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.904 -1.122 . . . . 0.0 111.529 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.3 p -174.83 149.14 1.14 Allowed 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.572 -1.33 . . . . 0.0 110.646 178.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 tttt -85.07 88.84 7.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.986 -1.071 . . . . 0.0 111.776 -177.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.422 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.0 tt0 -166.97 -174.56 2.73 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.277 -0.889 . . . . 0.0 110.408 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.09 152.73 47.63 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.039 -1.038 . . . . 0.0 109.656 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.502 HD13 ' HD3' ' A' ' 31' ' ' ARG . 80.9 mt -105.25 118.82 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.344 -0.847 . . . . 0.0 110.024 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 29' ' ' VAL . 57.2 t -115.65 159.0 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.228 -0.92 . . . . 0.0 109.96 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -49.99 132.94 23.1 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.28 -0.888 . . . . 0.0 110.752 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.37 9.7 40.76 Favored Glycine 0 N--CA 1.494 2.531 0 C-N-CA 120.083 -1.056 . . . . 0.0 111.591 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.8 p -123.65 135.13 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 CA-C-N 119.682 1.741 . . . . 0.0 110.536 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 23.8 p -87.01 141.59 28.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.229 -0.92 . . . . 0.0 110.239 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.502 ' HD3' HD13 ' A' ' 25' ' ' ILE . 2.2 ptt180 -138.85 144.52 39.26 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -0.943 . . . . 0.0 110.349 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.437 HG23 ' O ' ' A' ' 7' ' ' CYS . 12.2 mt -106.51 126.9 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.222 -0.924 . . . . 0.0 109.277 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.0 133.74 11.54 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.251 -1.539 . . . . 0.0 109.251 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.467 ' HE2' HG21 ' A' ' 36' ' ' VAL . 33.0 tttt -103.77 121.83 43.83 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.159 -1.201 . . . . 0.0 109.298 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.97 112.6 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.154 -0.966 . . . . 0.0 110.411 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.467 HG21 ' HE2' ' A' ' 34' ' ' LYS . 65.3 t -120.37 141.4 31.86 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.141 -0.975 . . . . 0.0 109.727 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -74.63 129.64 12.89 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.259 1.137 . . . . 0.0 110.431 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -103.55 156.96 34.81 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.149 -0.969 . . . . 0.0 110.107 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.95 110.63 3.08 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 O-C-N 123.432 1.227 . . . . 0.0 110.407 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 54.35 98.78 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.0 -1.062 . . . . 0.0 110.774 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.0 m -111.84 156.36 22.13 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.195 -0.941 . . . . 0.0 110.203 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -101.84 -45.4 5.23 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.288 -0.883 . . . . 0.0 110.759 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.0 t -88.15 -44.15 11.11 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.052 -1.03 . . . . 0.0 110.454 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -147.74 135.42 5.57 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.74 -38.98 96.06 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -107.6 146.96 31.25 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.228 -1.16 . . . . 0.0 110.068 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.4 ttm -117.08 151.51 36.66 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.187 -0.946 . . . . 0.0 110.608 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HD2' ' CZ2' ' A' ' 50' ' ' TRP . 7.8 pttt -131.71 142.7 49.87 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.341 -0.849 . . . . 0.0 109.905 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -120.8 134.23 55.3 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.102 -0.999 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CZ2' ' HD2' ' A' ' 48' ' ' LYS . 17.0 m95 -91.56 114.47 27.01 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.074 -1.016 . . . . 0.0 110.591 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.539 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 0.8 OUTLIER -125.44 171.0 10.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.611 177.803 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.48 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 71.0 m80 -87.74 -173.5 4.34 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.49 -0.756 . . . . 0.0 110.028 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.554 HG22 ' ND1' ' A' ' 93' ' ' HIS . 30.8 mm -84.61 -52.75 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -60.22 -37.85 81.57 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.222 -0.924 . . . . 0.0 109.259 178.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -61.49 -51.29 69.26 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.25 -0.906 . . . . 0.0 109.083 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.42 ' HB2' ' CD1' ' A' ' 51' ' ' TYR . 9.0 tpt -68.94 -44.41 73.1 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.339 -0.851 . . . . 0.0 109.302 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 10.6 m-85 -64.12 -29.72 70.83 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 119.157 -1.017 . . . . 0.0 109.721 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.48 -40.09 85.86 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.989 -1.069 . . . . 0.0 109.391 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -66.22 -40.17 90.1 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.236 -0.915 . . . . 0.0 109.114 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.6 mp -57.8 -42.18 83.65 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.205 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -58.84 -35.65 73.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.221 -0.924 . . . . 0.0 109.53 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -105.23 30.56 5.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.228 -0.92 . . . . 0.0 110.457 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -116.96 168.84 9.88 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.022 -1.049 . . . . 0.0 110.072 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -62.64 152.95 33.79 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.169 -0.957 . . . . 0.0 109.999 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.42 -34.67 20.08 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.183 -0.948 . . . . 0.0 110.628 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.45 -36.1 42.58 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.988 -1.07 . . . . 0.0 110.876 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 m -111.2 114.04 26.97 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.079 -1.013 . . . . 0.0 110.181 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.97 144.98 43.94 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.181 -0.949 . . . . 0.0 110.181 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.07 153.92 28.61 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.188 -0.945 . . . . 0.0 110.263 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.7 mt 54.49 100.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.079 0 O-C-N 121.197 -0.939 . . . . 0.0 110.804 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -107.02 134.09 50.69 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.126 -0.984 . . . . 0.0 109.577 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 53.83 -163.65 0.1 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.996 -1.065 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.71 HD21 ' HG2' ' A' ' 87' ' ' LYS . 58.1 tp -103.87 73.87 1.19 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.984 -1.073 . . . . 0.0 109.811 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.85 -160.0 0.32 Allowed 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.182 -0.949 . . . . 0.0 110.406 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.609 ' O ' HD12 ' A' ' 76' ' ' LEU . 4.8 mm-40 54.6 38.89 30.7 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.911 -1.118 . . . . 0.0 110.238 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.609 HD12 ' O ' ' A' ' 75' ' ' GLU . 1.1 tp -141.85 150.92 42.22 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.304 -0.873 . . . . 0.0 109.412 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -100.89 104.47 15.68 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.137 -0.977 . . . . 0.0 110.829 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.739 ' CA ' HD12 ' A' ' 82' ' ' LEU . . . 140.78 -37.97 1.61 Allowed Glycine 0 N--CA 1.493 2.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.51 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -62.15 -28.18 69.47 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.931 -1.335 . . . . 0.0 111.022 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -51.42 -32.27 25.87 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.853 -1.154 . . . . 0.0 111.87 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -165.1 50.94 0.11 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.62 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.739 HD12 ' CA ' ' A' ' 78' ' ' GLY . 18.0 mt -118.31 -67.73 0.97 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.842 -1.162 . . . . 0.0 109.604 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.446 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 5.1 tp10 -121.0 127.81 52.12 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.143 -0.973 . . . . 0.0 109.815 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.4 -50.33 6.18 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.079 -1.013 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.49 -46.43 88.49 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.193 -0.942 . . . . 0.0 109.628 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -62.76 -36.92 84.63 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.438 -0.905 . . . . 0.0 109.722 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.885 ' HA ' HD12 ' A' ' 90' ' ' ILE . 19.6 ttpt -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.141 -0.974 . . . . 0.0 109.793 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.61 -41.73 97.87 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.18 -0.95 . . . . 0.0 109.558 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -61.01 -36.2 78.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.234 -0.916 . . . . 0.0 110.181 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.885 HD12 ' HA ' ' A' ' 87' ' ' LYS . 44.9 mt -60.11 -38.04 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.081 -1.012 . . . . 0.0 109.775 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -39.91 86.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 120.905 -1.122 . . . . 0.0 109.771 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -59.66 -38.38 81.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 109.737 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.554 ' ND1' HG22 ' A' ' 53' ' ' ILE . 20.7 m-70 -56.46 -47.18 79.71 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.157 -0.964 . . . . 0.0 110.137 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.481 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.9 mp -64.88 -39.75 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.182 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.38 -40.43 81.39 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.16 -0.962 . . . . 0.0 109.383 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -64.25 -40.17 95.46 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.251 -0.906 . . . . 0.0 109.515 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 97' ' ' LEU . 9.2 tp -71.09 -33.38 70.12 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.247 -0.908 . . . . 0.0 110.233 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 40.3 t -102.76 40.06 1.43 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.047 -1.033 . . . . 0.0 110.171 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 7.6 t -164.91 132.33 3.1 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.177 -0.952 . . . . 0.0 110.842 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -123.06 -65.38 1.1 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.183 -0.948 . . . . 0.0 110.247 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -143.38 -165.3 2.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.243 -0.911 . . . . 0.0 110.253 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -115.43 175.49 5.5 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.144 -0.972 . . . . 0.0 110.138 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -65.18 108.76 2.5 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.12 146.22 39.09 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.231 -1.158 . . . . 0.0 110.171 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.47 88.57 1.0 Allowed 'Trans proline' 0 C--N 1.319 -1.025 0 O-C-N 123.341 1.18 . . . . 0.0 110.402 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.4 tttp -143.53 142.4 31.11 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.5 mptt -122.76 147.4 46.55 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.267 -0.896 . . . . 0.0 110.143 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -131.24 -60.64 0.95 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.157 -0.964 . . . . 0.0 110.207 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -135.23 144.71 47.04 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.211 -0.93 . . . . 0.0 110.155 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 27.5 m -131.17 141.14 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.205 -0.935 . . . . 0.0 110.471 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.7 t -139.81 133.03 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.147 -0.97 . . . . 0.0 110.007 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -133.01 147.24 52.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.167 -0.958 . . . . 0.0 110.32 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -120.83 141.28 50.71 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.175 -0.953 . . . . 0.0 110.096 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -116.64 131.49 56.94 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.178 -0.951 . . . . 0.0 110.295 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.3 tt -120.16 112.79 19.53 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.203 -0.935 . . . . 0.0 110.247 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 21.3 m -117.77 105.45 11.98 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.202 -0.936 . . . . 0.0 110.22 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.7 p . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.205 179.995 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.04 161.7 35.35 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.243 -0.91 . . . . 0.0 110.203 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -140.45 -65.33 0.45 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.294 -0.879 . . . . 0.0 110.259 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -118.0 162.16 18.62 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.197 -0.94 . . . . 0.0 110.261 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -130.43 148.41 52.24 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.163 -0.961 . . . . 0.0 110.295 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.758 ' HB3' HD22 ' A' ' 76' ' ' LEU . 2.8 m-85 -114.09 153.48 29.4 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.316 -0.865 . . . . 0.0 110.25 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -135.69 124.68 24.24 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.438 -0.789 . . . . 0.0 109.318 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.822 HG12 HG23 ' A' ' 32' ' ' ILE . 20.5 m -101.16 134.57 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 O-C-N 121.222 -0.924 . . . . 0.0 110.736 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -143.89 108.4 4.85 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.558 ' CD2' HD13 ' A' ' 82' ' ' LEU . 11.6 m-85 -56.08 158.85 3.68 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.105 -0.997 . . . . 0.0 110.304 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.32 119.01 32.46 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.363 -0.836 . . . . 0.0 110.007 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -111.14 -53.11 2.74 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.165 -0.96 . . . . 0.0 110.39 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -139.93 96.5 3.07 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.184 -0.947 . . . . 0.0 110.191 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 143.45 122.33 1.66 Allowed Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.65 HG22 ' HA ' ' A' ' 26' ' ' VAL . 75.8 p -115.78 144.2 44.32 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.198 -1.178 . . . . 0.0 109.875 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -154.86 151.49 28.66 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.219 -0.926 . . . . 0.0 111.228 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.98 125.19 32.45 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 108.696 -1.761 . . . . 0.0 108.696 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.485 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 23.8 p -63.85 126.96 29.3 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.198 -1.178 . . . . 0.0 110.892 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.437 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 37.8 mmtt -74.89 156.27 36.57 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.601 -0.687 . . . . 0.0 109.178 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.46 15.54 10.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.938 -1.101 . . . . 0.0 111.601 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.409 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 8.6 p -174.88 150.39 1.25 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.515 -1.366 . . . . 0.0 110.767 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 89.64 7.88 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.043 -1.036 . . . . 0.0 111.668 -178.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.417 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.0 tt0 -167.02 -173.95 2.51 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.312 -0.867 . . . . 0.0 110.289 178.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -130.05 149.19 51.87 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.074 -1.016 . . . . 0.0 109.819 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.661 HG23 ' CG1' ' A' ' 29' ' ' VAL . 81.2 mt -101.24 120.74 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.194 -0.941 . . . . 0.0 109.711 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.65 ' HA ' HG22 ' A' ' 15' ' ' THR . 59.8 t -108.57 157.02 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.233 -0.917 . . . . 0.0 110.061 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.3 mtpp -51.39 126.73 17.89 Favored 'General case' 0 N--CA 1.514 2.747 0 O-C-N 121.273 -0.892 . . . . 0.0 110.704 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 104.3 9.67 35.71 Favored Glycine 0 N--CA 1.496 2.649 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.843 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.661 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.6 p -113.78 135.03 54.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.783 1.792 . . . . 0.0 110.436 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.448 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.3 p -78.36 133.77 37.53 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.193 -0.942 . . . . 0.0 109.903 179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.3 ptt-85 -132.24 140.33 48.62 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.157 -0.964 . . . . 0.0 110.18 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.822 HG23 HG12 ' A' ' 8' ' ' VAL . 9.9 mt -107.83 125.24 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.26 -0.9 . . . . 0.0 109.447 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.57 144.86 15.89 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.439 ' HB3' ' CE2' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -119.43 135.21 54.85 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.118 -1.225 . . . . 0.0 109.453 179.336 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.7 t -111.98 111.78 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.943 -1.098 . . . . 0.0 110.241 -179.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.5 t -116.45 112.41 41.36 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.242 -0.912 . . . . 0.0 109.758 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.94 126.08 10.96 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 123.232 1.122 . . . . 0.0 110.503 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -105.37 118.57 55.4 Favored Pre-proline 0 N--CA 1.498 1.969 0 O-C-N 121.187 -0.946 . . . . 0.0 110.01 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.05 71.76 2.8 Favored 'Trans proline' 0 N--CA 1.485 1.024 0 O-C-N 123.147 1.077 . . . . 0.0 110.342 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -145.18 -59.12 0.35 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.092 -1.005 . . . . 0.0 110.331 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.4 t -108.35 156.98 18.79 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.153 -0.967 . . . . 0.0 110.181 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -97.58 -41.28 8.22 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.159 -0.963 . . . . 0.0 110.468 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 53.4 m -55.93 -39.32 71.5 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.003 -1.061 . . . . 0.0 110.333 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.16 -72.12 1.18 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.95 -77.31 2.14 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -132.45 143.62 49.91 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.183 -1.187 . . . . 0.0 110.264 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.7 mmm -117.84 135.43 54.09 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.222 -0.923 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -116.77 143.87 45.14 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.258 -0.901 . . . . 0.0 109.713 179.563 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -132.09 137.75 47.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.088 -1.007 . . . . 0.0 110.459 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.419 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 25.8 m95 -94.05 117.19 29.76 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.087 -1.008 . . . . 0.0 110.82 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.523 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.92 172.38 10.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.032 -1.042 . . . . 0.0 109.689 177.679 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.485 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.1 m80 -88.96 -173.11 3.95 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.335 -0.853 . . . . 0.0 110.238 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.531 HG22 ' ND1' ' A' ' 93' ' ' HIS . 23.0 mm -86.13 -50.77 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -61.87 -38.47 88.39 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.097 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.1 m -61.78 -50.94 70.32 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.172 -0.955 . . . . 0.0 108.98 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.431 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -67.28 -45.42 76.67 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.465 -0.772 . . . . 0.0 109.655 179.796 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.67 -28.65 68.63 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 119.214 -0.995 . . . . 0.0 110.023 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.09 -42.43 76.18 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 120.896 -1.128 . . . . 0.0 108.894 178.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -74.97 -42.32 57.83 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.8 tp -62.39 -38.89 91.38 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.407 -0.808 . . . . 0.0 109.143 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -67.03 -32.73 74.14 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.183 -0.948 . . . . 0.0 110.131 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -102.42 16.37 26.47 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.046 -1.034 . . . . 0.0 111.699 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.36 97.96 3.72 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.668 -1.27 . . . . 0.0 110.131 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.17 102.09 7.76 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.203 -0.935 . . . . 0.0 110.276 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' A' ' 66' ' ' THR . . . -90.07 -38.81 13.31 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.205 -0.934 . . . . 0.0 110.22 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 65' ' ' ALA . 18.5 m -165.14 -55.3 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.193 -0.942 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.1 t -116.55 162.43 17.61 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.289 -0.882 . . . . 0.0 110.398 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -96.34 146.18 24.96 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.226 -0.921 . . . . 0.0 110.079 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -100.03 160.55 14.23 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.215 -0.928 . . . . 0.0 110.177 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.1 mt 55.28 99.22 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.147 -0.971 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -110.2 134.6 52.06 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.264 -0.898 . . . . 0.0 109.685 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.47 -164.75 0.09 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.059 -1.026 . . . . 0.0 110.206 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.536 HD22 ' OG1' ' A' ' 91' ' ' THR . 25.9 tp -121.7 53.84 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.08 -1.012 . . . . 0.0 110.765 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.42 37.03 0.47 Allowed 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.175 -0.953 . . . . 0.0 110.755 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.47 ' O ' HD23 ' A' ' 76' ' ' LEU . 1.4 tm-20 -133.63 30.27 3.8 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.1 -1.0 . . . . 0.0 110.533 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.758 HD22 ' HB3' ' A' ' 6' ' ' PHE . 88.7 mt -134.08 154.68 51.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.015 -1.053 . . . . 0.0 109.722 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -86.2 104.01 15.35 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.194 -0.941 . . . . 0.0 110.502 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.407 ' HA3' HG23 ' A' ' 8' ' ' VAL . . . 148.2 -36.77 1.1 Allowed Glycine 0 N--CA 1.493 2.498 0 C-N-CA 119.766 -1.207 . . . . 0.0 110.893 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.459 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 17.3 p-90 -57.88 -35.23 70.7 Favored 'General case' 0 N--CA 1.509 2.511 0 CA-C-N 119.034 1.417 . . . . 0.0 110.838 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.459 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 1.9 tp10 -74.92 -29.38 60.95 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.021 -1.05 . . . . 0.0 110.862 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -99.01 -25.59 14.51 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.917 -1.114 . . . . 0.0 112.004 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.558 HD13 ' CD2' ' A' ' 10' ' ' TYR . 64.2 mt -76.21 -175.57 3.22 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.679 -1.263 . . . . 0.0 110.273 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -63.31 152.74 37.04 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.188 -0.945 . . . . 0.0 110.345 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -88.26 -40.18 13.85 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.189 -0.944 . . . . 0.0 110.22 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -60.17 -51.51 69.26 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.218 -0.926 . . . . 0.0 109.842 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.449 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 42.8 mt-10 -61.49 -40.0 92.99 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.254 -0.903 . . . . 0.0 109.326 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.666 ' HA ' HD12 ' A' ' 90' ' ' ILE . 1.2 tmmt? -59.56 -41.07 89.32 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.328 -0.857 . . . . 0.0 109.535 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -54.54 -33.6 60.37 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.209 -0.932 . . . . 0.0 110.364 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -57.63 -37.62 73.61 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.994 -1.066 . . . . 0.0 110.206 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.666 HD12 ' HA ' ' A' ' 87' ' ' LYS . 7.2 mt -62.36 -36.79 76.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.119 -0.988 . . . . 0.0 109.511 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.536 ' OG1' HD22 ' A' ' 73' ' ' LEU . 28.0 m -58.15 -38.13 76.01 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.899 -1.125 . . . . 0.0 109.6 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -57.79 -38.11 74.9 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.302 -0.874 . . . . 0.0 109.765 179.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.531 ' ND1' HG22 ' A' ' 53' ' ' ILE . 5.7 m-70 -58.56 -53.5 57.58 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -61.92 -38.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.396 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.95 92.67 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.176 -0.952 . . . . 0.0 109.774 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -60.94 -39.33 89.07 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.157 -0.964 . . . . 0.0 109.798 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.02 -34.58 68.94 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 110.349 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.5 t -101.07 62.84 0.98 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.025 -1.047 . . . . 0.0 110.197 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.1 t -132.5 40.18 3.31 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.144 -0.972 . . . . 0.0 110.223 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -141.63 134.2 28.38 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.085 -1.009 . . . . 0.0 110.227 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -141.32 123.55 15.65 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.13 -0.981 . . . . 0.0 110.248 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.24 77.99 1.56 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.211 -0.931 . . . . 0.0 110.189 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 71.42 133.81 0.12 Allowed Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.384 -1.487 . . . . 0.0 109.384 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 23.6 m -143.6 60.94 9.13 Favored Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.2 -1.177 . . . . 0.0 110.319 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.91 119.06 5.85 Favored 'Trans proline' 0 C--N 1.318 -1.079 0 O-C-N 123.365 1.192 . . . . 0.0 110.322 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -143.28 149.1 37.39 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.175 -0.953 . . . . 0.0 110.409 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -134.98 141.61 46.28 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.294 -0.879 . . . . 0.0 110.142 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -120.9 96.91 5.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.097 -1.002 . . . . 0.0 110.248 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -128.28 109.8 11.8 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.249 -0.907 . . . . 0.0 110.122 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.6 t -127.54 122.2 58.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.216 -0.928 . . . . 0.0 109.969 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.4 t -133.24 106.04 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.205 -0.934 . . . . 0.0 109.99 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -132.82 110.95 10.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.18 -0.95 . . . . 0.0 110.156 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.29 122.04 41.92 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.119 -0.988 . . . . 0.0 110.223 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 17.6 mttt -123.18 121.69 36.57 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.274 -0.891 . . . . 0.0 110.142 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.8 tp -117.74 137.04 52.97 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.211 -0.931 . . . . 0.0 110.222 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -141.63 111.18 6.49 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.309 -0.869 . . . . 0.0 110.131 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.568 ' O ' HG22 ' A' ' 117' ' ' THR . 25.1 m . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.198 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 ptt? . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.736 0.303 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -116.9 142.84 46.42 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.149 -0.969 . . . . 0.0 110.188 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -123.43 -61.45 1.4 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.239 -0.913 . . . . 0.0 110.267 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -134.95 116.43 14.7 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.217 -0.927 . . . . 0.0 110.194 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.1 mtp85 -120.06 145.66 46.65 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.185 -0.947 . . . . 0.0 110.273 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.522 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.4 m-85 -125.37 142.38 51.53 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.301 -0.874 . . . . 0.0 110.133 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.3 t -125.66 157.51 37.09 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.239 -0.913 . . . . 0.0 109.938 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.405 HG12 ' CD1' ' A' ' 82' ' ' LEU . 52.0 t -113.31 116.72 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.121 -0.987 . . . . 0.0 110.03 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.442 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 3.9 t70 -123.72 148.44 46.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.143 -0.973 . . . . 0.0 110.113 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.719 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -105.3 142.48 34.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.273 -0.892 . . . . 0.0 109.646 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.66 126.94 29.72 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.123 -0.986 . . . . 0.0 110.355 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -137.85 109.28 6.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.299 -0.876 . . . . 0.0 110.143 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 37.69 41.56 0.32 Allowed 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.62 164.77 26.62 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.3 m -144.4 122.43 12.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.124 -1.221 . . . . 0.0 110.347 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -153.21 139.44 18.43 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.185 -0.947 . . . . 0.0 111.133 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.99 129.13 49.1 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.906 -1.677 . . . . 0.0 108.906 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.451 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 32.0 p -66.79 119.84 12.51 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.156 -1.202 . . . . 0.0 111.118 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 12.6 mmtp -68.25 159.41 31.3 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.271 -0.893 . . . . 0.0 109.192 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 tptt 63.59 19.38 11.68 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.524 -1.36 . . . . 0.0 110.757 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.5 p -177.47 153.42 0.91 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 120.575 -1.328 . . . . 0.0 110.716 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -91.83 86.71 5.99 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.011 -1.055 . . . . 0.0 111.65 -178.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -165.51 -172.52 2.46 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.278 -0.889 . . . . 0.0 110.516 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.9 ttpt -127.65 155.9 43.18 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.139 -0.976 . . . . 0.0 109.978 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.572 HD11 ' O ' ' A' ' 50' ' ' TRP . 70.5 mt -107.25 124.96 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.041 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 29' ' ' VAL . 34.1 m -130.29 156.13 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.233 -0.917 . . . . 0.0 110.144 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ttpt -48.96 129.22 17.14 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.336 -0.853 . . . . 0.0 110.855 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 116.83 -8.26 16.84 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.573 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.658 HG12 ' O ' ' A' ' 26' ' ' VAL . 7.3 p -125.09 134.85 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-N 119.795 1.797 . . . . 0.0 110.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 30.7 p -76.86 142.74 40.08 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.071 -1.018 . . . . 0.0 110.245 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.473 ' HD3' HG21 ' A' ' 25' ' ' ILE . 5.6 ptt180 -136.42 146.33 46.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.16 -0.962 . . . . 0.0 110.381 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.436 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 30.6 mt -113.81 132.69 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.287 -0.883 . . . . 0.0 109.902 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' O ' ' A' ' 49' ' ' GLU . . . -108.8 155.5 16.08 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.0 ttpm? -118.26 130.74 56.23 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.187 -1.184 . . . . 0.0 109.781 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.497 HG22 ' HB3' ' A' ' 48' ' ' LYS . 61.7 t -104.24 107.96 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.121 -0.987 . . . . 0.0 109.983 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.427 HG23 ' HD2' ' A' ' 37' ' ' PRO . 10.3 p -123.97 143.33 42.0 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.221 -0.925 . . . . 0.0 110.027 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.427 ' HD2' HG23 ' A' ' 36' ' ' VAL . 45.9 Cg_endo -72.12 146.91 47.42 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.228 1.12 . . . . 0.0 110.331 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -102.53 158.6 31.44 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.288 -0.883 . . . . 0.0 110.241 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.93 70.71 3.56 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.425 1.224 . . . . 0.0 110.379 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -151.38 -58.61 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.24 -0.913 . . . . 0.0 110.428 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -115.22 156.59 25.08 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.209 -0.932 . . . . 0.0 110.165 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -101.48 -48.96 4.17 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.198 -0.939 . . . . 0.0 110.198 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.5 t -60.83 -40.41 92.67 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.219 -0.926 . . . . 0.0 109.981 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -136.35 -155.67 7.2 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.06 49.66 1.32 Allowed Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -117.0 131.63 56.91 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.221 -1.164 . . . . 0.0 110.127 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 tpt -117.31 151.66 36.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.096 -1.002 . . . . 0.0 110.423 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.497 ' HB3' HG22 ' A' ' 35' ' ' VAL . 18.8 pttt -131.3 141.93 50.03 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.271 -0.893 . . . . 0.0 110.163 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.424 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 80.3 mt-10 -120.08 164.58 15.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.0 109.757 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.572 ' O ' HD11 ' A' ' 25' ' ' ILE . 18.3 m95 -113.9 128.25 56.32 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.065 -1.022 . . . . 0.0 110.735 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.522 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 7.0 p90 -151.94 173.42 14.85 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.492 177.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.451 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 47.9 m80 -80.91 176.71 9.58 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.579 -0.701 . . . . 0.0 112.555 -176.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.493 HG23 ' CE2' ' A' ' 57' ' ' PHE . 21.1 mt -88.73 -53.95 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -54.72 -36.53 64.84 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.053 -1.029 . . . . 0.0 109.583 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 7.2 m -63.02 -51.68 65.86 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.313 -0.867 . . . . 0.0 109.15 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.539 ' O ' HD13 ' A' ' 60' ' ' LEU . 7.5 tpt -69.03 -42.35 76.49 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.736 -0.786 . . . . 0.0 109.459 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.493 ' CE2' HG23 ' A' ' 53' ' ' ILE . 12.8 m-85 -67.46 -30.57 70.32 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.981 179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.94 -40.79 62.82 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.859 -1.15 . . . . 0.0 109.059 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -58.66 -39.31 80.26 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.369 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 56' ' ' MET . 6.7 mp -53.59 -41.87 67.05 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.158 -0.964 . . . . 0.0 109.263 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.5 -36.08 75.37 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.257 -0.902 . . . . 0.0 109.5 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.18 33.2 4.41 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.229 -0.92 . . . . 0.0 110.345 179.276 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -101.11 169.37 8.98 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.981 -1.075 . . . . 0.0 110.499 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 4.9 ttt-85 -62.26 158.31 17.49 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.225 -0.922 . . . . 0.0 110.324 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.77 -31.59 72.33 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.222 -0.924 . . . . 0.0 111.109 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.4 p -95.98 53.18 1.36 Allowed 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.849 -1.157 . . . . 0.0 110.393 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 m -116.97 163.29 16.44 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.097 -1.002 . . . . 0.0 110.067 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -94.8 145.41 24.9 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.151 -0.968 . . . . 0.0 109.712 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.435 ' HB2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -128.92 161.68 29.3 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.236 -0.915 . . . . 0.0 110.816 -179.391 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.7 mt -89.52 124.0 42.01 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.255 -0.903 . . . . 0.0 109.877 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -116.36 148.25 40.8 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.263 -0.898 . . . . 0.0 110.188 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.14 177.34 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.079 -1.013 . . . . 0.0 110.683 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.752 HD13 ' CG2' ' A' ' 90' ' ' ILE . 61.5 tp -127.85 87.81 2.67 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.207 -0.933 . . . . 0.0 110.368 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.613 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -172.38 -51.35 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.199 -0.938 . . . . 0.0 110.84 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.87 -35.65 33.86 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 121.027 -1.046 . . . . 0.0 110.603 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.15 150.89 44.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.131 -0.981 . . . . 0.0 109.659 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -101.96 123.51 45.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.18 -0.95 . . . . 0.0 110.174 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 135.78 -36.86 1.97 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.47 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 43.0 p-90 -56.37 -37.37 69.97 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.939 -1.33 . . . . 0.0 110.685 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.47 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 2.9 tm-20 -71.87 -37.41 70.21 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.7 -29.14 69.07 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.184 -0.947 . . . . 0.0 111.037 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.719 HD13 ' CD2' ' A' ' 10' ' ' TYR . 85.0 mt -81.39 -173.77 4.55 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.851 -1.155 . . . . 0.0 110.262 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.54 162.36 12.96 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.204 -0.935 . . . . 0.0 110.469 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -86.6 -41.1 14.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.273 -0.892 . . . . 0.0 110.137 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -60.83 -47.62 85.53 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.267 -0.895 . . . . 0.0 109.435 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.431 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 17.6 mt-10 -60.61 -39.05 86.76 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.356 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.61 ' HG2' HD21 ' A' ' 73' ' ' LEU . 6.1 ttpt -56.17 -40.09 73.35 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.788 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.93 -36.07 69.79 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.218 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.58 -36.14 75.65 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.002 -1.061 . . . . 0.0 110.424 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.752 ' CG2' HD13 ' A' ' 73' ' ' LEU . 53.4 mt -65.26 -40.08 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.03 -1.044 . . . . 0.0 109.565 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -44.37 96.26 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.026 -1.046 . . . . 0.0 109.081 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -64.82 -39.63 93.89 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.489 ' NE2' HG22 ' A' ' 53' ' ' ILE . 16.8 t60 -57.08 -48.0 79.65 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.23 -0.919 . . . . 0.0 109.742 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.429 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 11.6 mt -65.09 -38.49 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.281 -0.967 . . . . 0.0 109.132 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.12 84.79 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.189 -0.944 . . . . 0.0 109.666 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.05 -37.38 82.42 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.236 -0.915 . . . . 0.0 110.002 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.476 HD22 ' HD1' ' A' ' 57' ' ' PHE . 19.6 tp -81.42 -38.27 26.76 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.061 -1.024 . . . . 0.0 110.112 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 30.4 t -74.61 -38.25 62.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.32 165.11 12.23 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.136 -0.977 . . . . 0.0 110.03 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -123.47 174.53 7.32 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.129 -0.982 . . . . 0.0 110.315 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -132.8 -165.15 1.56 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.283 -0.885 . . . . 0.0 110.177 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.16 166.17 12.33 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.183 -0.948 . . . . 0.0 110.173 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -77.54 138.3 21.48 Favored Glycine 0 N--CA 1.492 2.428 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 7.8 t -141.19 146.89 44.9 Favored Pre-proline 0 N--CA 1.495 1.786 0 O-C-N 121.267 -1.137 . . . . 0.0 110.296 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.99 83.96 1.36 Allowed 'Trans proline' 0 C--N 1.318 -1.07 0 O-C-N 123.314 1.165 . . . . 0.0 110.442 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.9 tttt 52.7 86.37 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.076 -1.015 . . . . 0.0 110.805 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -134.1 46.74 2.48 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.189 -0.944 . . . . 0.0 110.17 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -121.68 92.08 3.66 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.136 -0.977 . . . . 0.0 110.28 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.32 162.74 17.42 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.15 -0.969 . . . . 0.0 110.179 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.64 147.27 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.279 -0.888 . . . . 0.0 110.21 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.9 t -117.84 143.06 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.199 -0.938 . . . . 0.0 109.933 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -117.17 123.47 46.78 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.22 -0.925 . . . . 0.0 110.224 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.73 141.36 48.69 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.156 -0.965 . . . . 0.0 110.13 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -116.0 102.82 9.99 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.233 -0.917 . . . . 0.0 110.15 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -120.68 120.01 34.48 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.216 -0.928 . . . . 0.0 110.177 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 29.6 m -125.98 124.18 40.16 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.212 -0.93 . . . . 0.0 110.19 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 12.1 p . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.224 -179.984 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 ttt . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -121.24 -173.76 2.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.126 -0.984 . . . . 0.0 110.202 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -147.27 84.13 1.57 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.224 -0.922 . . . . 0.0 110.437 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -125.84 141.83 51.8 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.157 -0.964 . . . . 0.0 110.227 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.55 139.51 52.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.16 -0.962 . . . . 0.0 110.143 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.505 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.9 m-85 -119.74 154.66 33.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.182 -0.948 . . . . 0.0 110.326 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -143.76 134.29 24.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.318 -0.864 . . . . 0.0 110.298 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.783 HG23 HD23 ' A' ' 76' ' ' LEU . 47.7 t -102.5 105.76 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.223 -0.923 . . . . 0.0 109.671 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -118.02 159.45 23.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.14 -0.975 . . . . 0.0 110.874 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.73 149.1 27.65 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.545 -0.722 . . . . 0.0 109.637 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.43 123.74 27.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.173 -0.954 . . . . 0.0 109.953 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -149.65 39.36 0.79 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.183 -0.948 . . . . 0.0 110.588 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -136.38 -66.03 0.55 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.215 -0.928 . . . . 0.0 110.156 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.69 -137.67 2.52 Favored Glycine 0 N--CA 1.497 2.745 0 N-CA-C 110.064 -1.215 . . . . 0.0 110.064 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.946 HG22 HG12 ' A' ' 26' ' ' VAL . 70.3 p -122.78 116.22 23.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.231 -1.158 . . . . 0.0 110.038 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 134.67 54.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.131 -0.981 . . . . 0.0 110.653 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.27 123.12 31.55 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 108.527 -1.829 . . . . 0.0 108.527 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.493 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 26.3 p -64.59 129.09 38.5 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.29 -1.123 . . . . 0.0 110.914 -178.287 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 35.5 mmtt -75.45 156.02 35.7 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.578 -0.701 . . . . 0.0 109.251 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 65.76 15.82 10.22 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.85 -1.156 . . . . 0.0 111.704 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.402 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 8.8 p -174.91 151.27 1.35 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.557 -1.339 . . . . 0.0 110.752 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -87.1 90.73 8.46 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.053 -1.029 . . . . 0.0 111.647 -177.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.436 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 0.4 OUTLIER -167.62 -174.0 2.35 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.332 -0.855 . . . . 0.0 110.412 178.947 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -126.08 154.03 43.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.989 -1.07 . . . . 0.0 110.036 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.556 HD13 ' HD3' ' A' ' 31' ' ' ARG . 80.4 mt -109.86 103.09 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.404 -0.81 . . . . 0.0 109.912 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.946 HG12 HG22 ' A' ' 15' ' ' THR . 22.9 m -110.98 162.98 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.259 -0.901 . . . . 0.0 110.397 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -49.6 137.27 15.73 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.415 -0.803 . . . . 0.0 111.033 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.36 50.74 Favored Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.184 -1.007 . . . . 0.0 111.499 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.1 p -126.86 137.36 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.73 1.765 . . . . 0.0 110.786 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.495 ' SG ' HD21 ' A' ' 82' ' ' LEU . 42.3 t -93.49 138.98 31.25 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.237 -0.914 . . . . 0.0 109.774 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.1 ptt180 -135.09 147.78 49.64 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.258 -0.901 . . . . 0.0 110.348 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.436 HG22 ' HD1' ' A' ' 6' ' ' PHE . 15.1 mt -106.33 123.83 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.313 -0.867 . . . . 0.0 109.523 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.24 137.22 13.32 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.458 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 37.4 ttpt -107.26 124.2 49.42 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.233 -1.157 . . . . 0.0 109.379 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.4 t -99.98 114.45 38.48 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.069 -1.019 . . . . 0.0 110.321 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.2 p -121.82 138.18 28.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.292 -0.88 . . . . 0.0 110.345 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.2 151.28 34.1 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 O-C-N 123.003 1.002 . . . . 0.0 110.458 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -102.84 162.75 19.2 Favored Pre-proline 0 N--CA 1.5 2.025 0 O-C-N 121.298 -0.876 . . . . 0.0 110.088 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.08 -43.12 1.24 Allowed 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.348 1.183 . . . . 0.0 110.334 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -126.1 98.93 5.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.235 -0.915 . . . . 0.0 110.038 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.421 ' OG ' ' HA2' ' A' ' 45' ' ' GLY . 9.5 p -140.22 125.25 18.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.227 -0.92 . . . . 0.0 110.205 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -102.55 -54.19 2.72 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.204 -0.935 . . . . 0.0 110.135 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.22 -40.9 12.54 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.224 -0.922 . . . . 0.0 110.107 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -80.29 -108.83 0.28 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.421 ' HA2' ' OG ' ' A' ' 41' ' ' SER . . . 123.68 -64.83 0.53 Allowed Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.76 143.83 44.44 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.255 -1.144 . . . . 0.0 109.986 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 mmt -116.82 139.08 51.02 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.172 -0.955 . . . . 0.0 110.285 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 6.1 ttmm -129.37 130.64 46.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.276 -0.89 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -114.68 138.74 50.34 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.204 -0.935 . . . . 0.0 109.82 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 11.5 m95 -93.98 112.76 24.63 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.191 -0.943 . . . . 0.0 110.852 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.505 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 0.7 OUTLIER -123.54 170.93 9.92 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.47 177.064 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.0 m80 -88.97 -173.88 4.25 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.442 -0.786 . . . . 0.0 110.338 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.558 HG22 ' CE1' ' A' ' 93' ' ' HIS . 34.7 mm -83.22 -54.61 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.49 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 tttp -60.07 -37.5 80.05 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.292 -0.88 . . . . 0.0 109.398 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.4 m -60.75 -51.22 70.28 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.208 -0.932 . . . . 0.0 109.14 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 11.3 tpt -69.21 -45.43 69.87 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.365 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 11.2 m-85 -63.21 -29.88 71.13 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.833 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -62.84 -41.55 99.39 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.885 -1.134 . . . . 0.0 109.122 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -40.88 92.11 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.226 -0.921 . . . . 0.0 108.927 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -55.78 -41.71 74.49 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.139 -0.976 . . . . 0.0 109.237 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.26 -35.45 71.76 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.314 -0.866 . . . . 0.0 109.581 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.7 mmt85 -105.97 31.16 5.27 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.196 -0.94 . . . . 0.0 110.544 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.94 168.5 9.43 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.987 -1.071 . . . . 0.0 110.086 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -62.9 153.83 32.16 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.217 -0.927 . . . . 0.0 110.09 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.88 -34.46 19.42 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.22 -0.925 . . . . 0.0 110.65 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.38 -35.78 40.33 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.96 -1.087 . . . . 0.0 110.91 -179.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.8 m -110.98 132.68 54.0 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.112 -0.993 . . . . 0.0 110.302 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -117.51 144.87 44.64 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.18 -0.95 . . . . 0.0 110.188 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.87 137.53 51.54 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.192 -0.943 . . . . 0.0 110.284 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.3 mt 54.21 99.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.08 -1.013 . . . . 0.0 110.782 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -107.43 139.18 42.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.188 -0.945 . . . . 0.0 109.403 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.62 -163.99 0.12 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.964 -1.085 . . . . 0.0 110.053 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.648 HD21 ' HG3' ' A' ' 87' ' ' LYS . 56.4 tp -116.08 70.84 0.76 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.034 -1.041 . . . . 0.0 110.473 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.68 -163.7 0.34 Allowed 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.229 -0.92 . . . . 0.0 110.314 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 54.44 37.45 27.76 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.996 -1.065 . . . . 0.0 110.259 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.783 HD23 HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -145.22 151.53 38.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.197 -0.94 . . . . 0.0 109.74 -179.774 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -94.49 97.18 9.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.123 -0.985 . . . . 0.0 109.99 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.12 -36.56 0.95 Allowed Glycine 0 N--CA 1.495 2.627 0 C-N-CA 119.72 -1.229 . . . . 0.0 110.752 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 52.8 p-90 -56.01 -34.78 66.14 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.921 1.36 . . . . 0.0 110.616 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.41 -43.81 96.42 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.052 -1.03 . . . . 0.0 109.439 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -60.45 -39.75 88.68 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.14 -0.975 . . . . 0.0 109.75 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.551 ' CD2' HD11 ' A' ' 90' ' ' ILE . 3.5 mp -49.38 173.56 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.907 0 O-C-N 121.219 -0.926 . . . . 0.0 110.643 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -101.23 161.0 13.93 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.069 -1.019 . . . . 0.0 110.383 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -55.59 -36.18 66.61 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.181 -0.949 . . . . 0.0 110.967 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -70.41 -43.48 69.9 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.063 -1.023 . . . . 0.0 109.452 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.41 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 22.2 mt-10 -70.64 -39.35 73.71 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.839 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.648 ' HG3' HD21 ' A' ' 73' ' ' LEU . 26.0 tttt -61.81 -37.43 84.38 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.286 -0.884 . . . . 0.0 109.853 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -65.91 -40.25 91.32 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.149 -0.969 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.33 79.72 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.241 -0.912 . . . . 0.0 110.538 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.6 HG22 HD13 ' A' ' 73' ' ' LEU . 98.5 mt -68.19 -36.99 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 O-C-N 121.113 -0.992 . . . . 0.0 109.434 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.43 -38.92 88.89 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.886 -1.134 . . . . 0.0 109.451 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -57.39 -37.96 73.51 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.164 -0.96 . . . . 0.0 109.874 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.558 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.7 m-70 -55.01 -47.8 74.2 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.116 -0.99 . . . . 0.0 110.066 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mp -66.0 -38.89 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.238 -0.914 . . . . 0.0 109.197 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.26 79.21 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.186 -0.946 . . . . 0.0 109.696 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.8 -36.97 85.01 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.168 -0.958 . . . . 0.0 109.903 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.2 tp -82.31 -30.9 30.24 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.066 -1.021 . . . . 0.0 110.646 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.8 t -101.26 55.78 0.84 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.869 -1.145 . . . . 0.0 110.263 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 p -135.57 77.14 1.65 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.015 . . . . 0.0 110.247 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 41.8 tttt -143.58 -59.19 0.41 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.183 -0.948 . . . . 0.0 110.34 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -145.09 40.11 1.23 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.148 -0.97 . . . . 0.0 110.297 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.42 -167.45 2.34 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.145 -0.972 . . . . 0.0 110.215 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.42 ' O ' ' OG1' ' A' ' 104' ' ' THR . . . 115.53 91.76 1.76 Allowed Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 103' ' ' GLY . 82.6 p 46.61 89.75 0.09 OUTLIER Pre-proline 0 N--CA 1.504 2.246 0 O-C-N 121.324 -1.103 . . . . 0.0 111.436 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -73.19 -40.38 1.72 Allowed 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.471 1.248 . . . . 0.0 110.417 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -132.0 -179.38 5.37 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.208 -0.933 . . . . 0.0 110.368 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 23.7 tttm -141.68 170.43 15.73 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.247 -0.908 . . . . 0.0 110.138 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -141.6 84.41 1.9 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.117 -0.99 . . . . 0.0 110.284 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.47 143.92 45.55 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.282 -0.886 . . . . 0.0 110.22 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 9.0 p -130.52 146.35 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.213 -0.929 . . . . 0.0 110.206 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -138.21 144.68 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.133 -0.979 . . . . 0.0 110.287 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -118.16 104.93 11.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.191 -0.943 . . . . 0.0 110.227 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.11 141.34 48.39 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.137 -0.977 . . . . 0.0 110.229 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -115.92 101.32 8.67 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.146 -0.971 . . . . 0.0 110.317 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.9 tp -117.65 150.21 39.42 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.205 -0.935 . . . . 0.0 110.072 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.4 p -134.94 109.19 8.31 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.179 -0.951 . . . . 0.0 110.275 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.194 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -127.27 49.03 2.14 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.306 -0.871 . . . . 0.0 110.152 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -121.54 161.57 22.1 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.14 -0.975 . . . . 0.0 110.283 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -117.33 139.18 51.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.205 -0.934 . . . . 0.0 110.173 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.76 126.18 51.98 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.233 -0.917 . . . . 0.0 110.177 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.822 ' HB3' HD11 ' A' ' 76' ' ' LEU . 1.5 m-85 -116.18 143.95 44.82 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.171 -0.956 . . . . 0.0 110.059 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.5 p -141.03 138.32 33.58 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.237 -0.914 . . . . 0.0 109.877 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.76 HG13 ' CD2' ' A' ' 76' ' ' LEU . 21.7 m -104.53 140.5 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.093 -1.004 . . . . 0.0 110.222 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -142.28 156.05 45.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.245 -0.909 . . . . 0.0 110.335 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -107.35 154.07 21.83 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.359 -0.838 . . . . 0.0 109.792 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.532 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . . . -82.33 142.27 32.18 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.243 -0.911 . . . . 0.0 110.058 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -143.51 -59.86 0.41 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.292 -0.88 . . . . 0.0 110.163 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.62 84.57 2.25 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.251 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.34 174.82 14.51 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.543 HG22 HG12 ' A' ' 26' ' ' VAL . 55.3 p -140.68 139.18 34.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.184 -1.186 . . . . 0.0 110.204 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -123.42 150.77 43.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.214 -0.929 . . . . 0.0 110.677 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.08 120.13 5.22 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.6 t -64.71 122.52 17.07 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.262 -1.14 . . . . 0.0 109.732 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.83 148.05 44.52 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.057 -1.027 . . . . 0.0 108.669 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp 53.0 64.93 1.67 Allowed 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.906 -1.121 . . . . 0.0 108.949 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -172.94 -43.65 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.221 -0.924 . . . . 0.0 112.555 -177.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tttm 70.06 44.85 0.75 Allowed 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.884 -1.135 . . . . 0.0 108.202 -177.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.72 -168.38 2.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.556 -0.715 . . . . 0.0 109.49 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -137.22 157.5 46.52 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.984 -1.073 . . . . 0.0 110.42 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.591 HG23 HG13 ' A' ' 29' ' ' VAL . 69.5 mt -110.95 110.28 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.402 -0.811 . . . . 0.0 109.826 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.798 ' O ' HG12 ' A' ' 29' ' ' VAL . 24.4 m -110.11 169.39 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 O-C-N 121.187 -0.946 . . . . 0.0 110.614 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HA ' ' HB3' ' A' ' 11' ' ' ALA . 35.8 tttt -46.6 138.61 5.8 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 121.56 -0.712 . . . . 0.0 111.136 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 107.57 -23.16 27.02 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.968 -1.11 . . . . 0.0 110.533 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.798 HG12 ' O ' ' A' ' 26' ' ' VAL . 14.8 p -113.52 137.59 46.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-N 119.151 1.475 . . . . 0.0 110.318 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.655 ' HB3' HD11 ' A' ' 53' ' ' ILE . 44.8 t -91.17 142.43 27.75 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.045 -1.035 . . . . 0.0 110.199 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.449 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 1.1 ptt180 -128.16 153.3 47.03 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.143 -0.973 . . . . 0.0 110.533 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.413 HD12 ' HG2' ' A' ' 56' ' ' MET . 11.4 mt -111.95 137.26 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.344 -0.847 . . . . 0.0 110.414 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.414 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.09 129.2 9.58 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 108.348 -1.901 . . . . 0.0 108.348 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.45 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 33.6 ttpt -110.15 116.96 32.47 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.069 -1.253 . . . . 0.0 110.395 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.6 t -109.24 109.4 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.222 -0.924 . . . . 0.0 110.017 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.3 t -120.53 112.57 34.03 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.215 -0.928 . . . . 0.0 109.961 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.3 133.75 19.82 Favored 'Trans proline' 0 C--N 1.32 -0.941 0 O-C-N 123.119 1.063 . . . . 0.0 110.393 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -103.48 118.84 56.67 Favored Pre-proline 0 N--CA 1.5 2.049 0 O-C-N 121.203 -0.935 . . . . 0.0 110.028 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.6 71.08 3.27 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 O-C-N 123.186 1.098 . . . . 0.0 110.396 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -150.49 -58.59 0.18 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.129 -0.982 . . . . 0.0 110.468 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.67 157.11 22.59 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.161 -0.962 . . . . 0.0 110.229 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -96.02 -39.22 9.86 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.248 -0.908 . . . . 0.0 110.461 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.7 m -57.23 -39.69 76.03 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.048 -1.032 . . . . 0.0 110.167 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -74.15 -60.85 3.42 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.22 -99.48 0.8 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -133.33 147.41 51.84 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.167 -1.196 . . . . 0.0 110.331 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.7 mtt -115.27 143.58 45.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.167 -0.958 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -118.6 123.88 46.08 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.225 -0.922 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -116.66 137.21 52.36 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.181 -0.949 . . . . 0.0 109.897 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 26.7 m95 -92.84 134.48 35.04 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.219 -0.925 . . . . 0.0 109.998 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -121.71 176.01 5.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.255 -0.903 . . . . 0.0 110.739 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.4 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 2.6 m80 -96.69 -172.36 2.47 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.876 HG22 ' CE1' ' A' ' 93' ' ' HIS . 39.8 mm -84.74 -37.14 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.998 -1.064 . . . . 0.0 109.275 178.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.45 -27.26 20.49 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.74 -1.225 . . . . 0.0 111.213 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 83.3 m -70.46 -46.49 63.7 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.819 -1.176 . . . . 0.0 110.435 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.413 ' HG2' HD12 ' A' ' 32' ' ' ILE . 9.7 tpt -68.8 -38.52 80.0 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.323 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.455 ' CE1' HG13 ' A' ' 94' ' ' ILE . 9.3 m-85 -75.05 -31.43 61.3 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.803 -1.159 . . . . 0.0 109.578 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -62.51 -36.21 81.82 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.026 -1.047 . . . . 0.0 109.524 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -60.24 -40.16 89.28 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.093 -1.005 . . . . 0.0 109.758 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.781 ' HB3' HD21 ' A' ' 97' ' ' LEU . 10.1 mp -60.96 -42.33 98.08 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.975 . . . . 0.0 109.154 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.4 ' N ' HD11 ' A' ' 97' ' ' LEU . 6.9 tt0 -56.08 -33.68 65.27 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.205 -0.935 . . . . 0.0 109.674 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 33.4 mtm-85 -102.63 29.59 5.21 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.279 -0.888 . . . . 0.0 110.449 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.14 169.41 8.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.905 -1.122 . . . . 0.0 109.902 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.96 146.77 25.36 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.184 -0.948 . . . . 0.0 110.177 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.14 -34.1 71.67 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.187 -0.946 . . . . 0.0 110.7 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.64 -35.72 31.95 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 121.028 -1.045 . . . . 0.0 111.075 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 29.7 m -113.57 121.57 44.62 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.069 -1.019 . . . . 0.0 110.285 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -118.15 144.52 45.63 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.192 -0.942 . . . . 0.0 110.176 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.402 ' O ' HD21 ' A' ' 60' ' ' LEU . 13.3 mtmt -124.58 139.4 53.91 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.129 -0.982 . . . . 0.0 110.402 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.2 mt 54.77 101.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.2 -0.937 . . . . 0.0 110.821 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -110.92 143.32 41.73 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.068 -1.02 . . . . 0.0 109.892 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.58 -170.75 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.039 -1.038 . . . . 0.0 110.477 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.709 HD21 ' CG ' ' A' ' 87' ' ' LYS . 2.8 tp -111.37 43.4 1.5 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.146 -0.971 . . . . 0.0 110.105 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.9 -168.9 3.24 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.141 -0.974 . . . . 0.0 110.051 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 55.42 38.11 29.83 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.905 -1.122 . . . . 0.0 109.935 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.822 HD11 ' HB3' ' A' ' 6' ' ' PHE . 1.5 tp -144.65 150.44 37.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.348 -0.845 . . . . 0.0 109.48 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -93.78 104.45 16.53 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.061 -1.024 . . . . 0.0 110.464 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.412 ' HA3' HG22 ' A' ' 8' ' ' VAL . . . 150.02 -45.26 0.68 Allowed Glycine 0 N--CA 1.494 2.514 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.762 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 34.0 p-90 -58.72 -35.51 72.79 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.004 -1.292 . . . . 0.0 110.614 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -56.17 -34.4 66.14 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.921 -1.112 . . . . 0.0 110.699 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -83.58 -34.87 25.08 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.953 -1.092 . . . . 0.0 110.722 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.651 ' CD2' HD11 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -49.77 175.1 0.01 OUTLIER 'General case' 0 N--CA 1.518 2.93 0 O-C-N 121.067 -1.02 . . . . 0.0 110.941 -179.682 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.76 161.61 13.53 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.312 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.59 -45.3 89.41 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.976 . . . . 0.0 110.41 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -61.52 -51.75 67.32 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.533 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.65 -39.33 94.09 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.111 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.763 ' HA ' HD12 ' A' ' 90' ' ' ILE . 19.9 ttpp -59.96 -38.75 83.39 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.305 -0.872 . . . . 0.0 109.709 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -60.32 -39.35 86.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.15 -0.969 . . . . 0.0 109.861 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.84 -40.95 90.25 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.14 -0.975 . . . . 0.0 110.1 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 87' ' ' LYS . 10.4 mt -62.28 -40.19 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 O-C-N 121.205 -0.934 . . . . 0.0 109.524 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.9 m -58.15 -39.62 79.25 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.04 -1.037 . . . . 0.0 109.921 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.8 -39.27 80.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.227 -0.92 . . . . 0.0 109.627 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.876 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.3 m-70 -60.01 -52.04 67.08 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.253 -0.904 . . . . 0.0 109.778 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.455 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.6 mt -62.68 -39.08 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.383 -0.927 . . . . 0.0 109.444 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.72 94.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.187 -0.946 . . . . 0.0 109.47 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.7 -39.7 66.78 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.229 -0.919 . . . . 0.0 109.11 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.781 HD21 ' HB3' ' A' ' 60' ' ' LEU . 21.6 tp -68.5 -32.58 72.66 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.267 -0.896 . . . . 0.0 110.363 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 16.3 t -92.81 -40.63 10.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.925 -1.109 . . . . 0.0 110.177 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t -128.23 166.56 18.33 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.143 -0.973 . . . . 0.0 110.147 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 35.1 tttm -138.88 110.2 6.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.207 -0.933 . . . . 0.0 110.306 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.41 161.34 20.68 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.193 -0.942 . . . . 0.0 110.233 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.46 144.65 40.19 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.238 -0.914 . . . . 0.0 110.28 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -128.05 -159.17 9.96 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.5 p -125.17 149.2 63.04 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.173 -1.193 . . . . 0.0 110.252 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.72 -43.21 0.93 Allowed 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.42 1.221 . . . . 0.0 110.415 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt -140.21 170.76 15.22 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.17 -0.956 . . . . 0.0 110.232 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.52 -63.67 1.4 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.251 -0.906 . . . . 0.0 110.271 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -117.19 73.45 0.87 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.199 -0.938 . . . . 0.0 110.204 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -119.6 167.49 11.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.179 -0.951 . . . . 0.0 110.123 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.6 t -114.21 132.78 62.28 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.217 -0.927 . . . . 0.0 109.991 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.4 p -136.01 143.29 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.196 -0.94 . . . . 0.0 110.151 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -118.73 126.96 53.06 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.261 -0.9 . . . . 0.0 110.244 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.62 101.5 8.41 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.158 -0.964 . . . . 0.0 110.137 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -117.19 137.23 52.48 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.169 -0.957 . . . . 0.0 110.248 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -119.91 153.5 35.79 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.217 -0.927 . . . . 0.0 110.17 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.33 136.05 53.5 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.206 -0.934 . . . . 0.0 110.215 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.304 -179.986 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 ttt . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.53 92.11 2.33 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.16 -0.962 . . . . 0.0 110.274 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -127.19 126.93 43.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.212 -0.93 . . . . 0.0 110.212 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.89 164.04 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.254 -0.904 . . . . 0.0 110.491 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -124.01 129.98 51.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.147 -0.971 . . . . 0.0 110.167 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.4 m-85 -124.02 137.44 54.59 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.158 -0.964 . . . . 0.0 110.086 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.2 t -126.77 147.87 49.96 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 109.628 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.888 ' CG1' HD23 ' A' ' 76' ' ' LEU . 27.2 m -116.18 139.63 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 121.057 -1.027 . . . . 0.0 110.604 179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -147.5 162.73 38.47 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.24 -0.913 . . . . 0.0 110.399 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.706 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.6 OUTLIER -110.29 141.55 43.12 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.368 -0.832 . . . . 0.0 109.814 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.439 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -63.93 134.06 54.4 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.744 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -140.62 -65.68 0.45 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.209 -0.932 . . . . 0.0 110.465 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -121.97 85.33 2.39 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.176 -0.953 . . . . 0.0 110.228 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 126.92 159.36 10.16 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -132.48 149.64 52.3 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.212 -1.169 . . . . 0.0 110.086 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.06 145.85 50.58 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.168 -0.958 . . . . 0.0 110.557 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.43 118.63 7.97 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.9 t -63.85 123.28 18.52 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.191 -1.182 . . . . 0.0 109.695 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HB2' ' CE2' ' A' ' 51' ' ' TYR . 0.8 OUTLIER -61.61 147.86 44.33 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.08 -1.013 . . . . 0.0 108.664 179.176 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt 53.09 64.66 1.78 Allowed 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.979 -1.076 . . . . 0.0 108.815 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -173.04 -43.58 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.249 -0.907 . . . . 0.0 112.583 -177.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt 69.06 44.15 1.04 Allowed 'General case' 0 N--CA 1.505 2.295 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -177.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 -168.71 2.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.564 -0.71 . . . . 0.0 109.437 -179.122 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -140.1 158.67 43.69 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.017 -1.052 . . . . 0.0 110.193 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.644 HG23 ' CG2' ' A' ' 29' ' ' VAL . 50.8 mt -102.89 118.12 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.505 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.3 t -107.76 160.25 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.162 -0.961 . . . . 0.0 110.352 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -48.49 121.7 4.74 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 121.444 -0.785 . . . . 0.0 111.15 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.68 -25.93 5.24 Favored Glycine 0 N--CA 1.493 2.448 0 C-N-CA 119.999 -1.096 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.644 ' CG2' HG23 ' A' ' 25' ' ' ILE . 6.6 m -104.38 137.61 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 CA-C-N 119.148 1.474 . . . . 0.0 110.488 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.919 ' HB3' HD11 ' A' ' 53' ' ' ILE . 1.3 t -81.06 134.99 35.76 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.192 -0.942 . . . . 0.0 109.647 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.432 ' CB ' HD13 ' A' ' 25' ' ' ILE . 12.0 ptt-85 -122.43 149.03 44.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.201 -0.937 . . . . 0.0 110.402 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.1 mt -108.35 139.87 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.315 -0.865 . . . . 0.0 110.603 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.03 122.38 6.9 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 41.0 tttt -105.97 120.07 40.83 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.101 -1.235 . . . . 0.0 110.082 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.429 HG12 ' CB ' ' A' ' 46' ' ' ASP . 62.1 t -103.5 107.17 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.25 -0.906 . . . . 0.0 110.22 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.7 t -122.31 138.31 28.89 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 109.615 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.92 131.89 16.24 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.262 1.138 . . . . 0.0 110.22 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 -103.19 154.31 37.76 Favored Pre-proline 0 N--CA 1.499 1.999 0 O-C-N 121.102 -0.999 . . . . 0.0 110.166 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -72.45 -40.25 2.32 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.43 1.226 . . . . 0.0 110.306 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -115.13 107.31 15.15 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.224 -0.922 . . . . 0.0 110.07 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.53 157.0 42.41 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.189 -0.945 . . . . 0.0 110.364 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -95.98 -39.34 9.82 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.241 -0.912 . . . . 0.0 110.401 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 t -87.76 -40.06 14.4 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.006 -1.059 . . . . 0.0 110.005 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 106.28 112.56 3.7 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 140.85 -148.5 20.14 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.429 ' CB ' HG12 ' A' ' 35' ' ' VAL . 0.9 OUTLIER -116.74 158.09 24.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.166 -1.196 . . . . 0.0 110.245 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttt -101.72 144.16 30.76 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.363 -0.836 . . . . 0.0 110.119 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HE3' ' CZ2' ' A' ' 50' ' ' TRP . 26.9 ttpt -116.53 123.01 46.37 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.327 -0.858 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -115.26 140.36 49.17 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.346 -0.846 . . . . 0.0 109.712 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.452 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 57.0 m95 -97.83 128.14 44.26 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.137 -0.977 . . . . 0.0 110.167 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 19' ' ' LYS . 97.4 m-85 -115.81 174.64 5.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.344 -0.847 . . . . 0.0 110.855 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.8 m80 -91.28 -171.43 2.95 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.98 HG22 ' CE1' ' A' ' 93' ' ' HIS . 46.6 mm -83.49 -39.9 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.879 -1.138 . . . . 0.0 109.722 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -85.06 -32.26 22.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 120.83 -1.169 . . . . 0.0 111.058 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 71.2 m -62.68 -52.89 61.51 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.994 -1.066 . . . . 0.0 110.4 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -40.39 88.02 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.012 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.673 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 9.6 m-85 -70.97 -30.43 66.7 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 119.08 -1.048 . . . . 0.0 109.634 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -61.35 -36.86 81.35 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.598 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.14 88.58 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.024 -1.048 . . . . 0.0 109.804 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 69' ' ' LYS . 10.2 mp -63.05 -44.42 95.92 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.429 -0.909 . . . . 0.0 108.969 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.38 -33.62 68.01 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.218 -0.926 . . . . 0.0 109.695 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.65 29.33 5.82 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.277 -0.889 . . . . 0.0 110.576 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -116.87 166.89 11.63 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.888 -1.133 . . . . 0.0 110.042 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -64.78 155.98 32.1 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.209 -0.932 . . . . 0.0 109.904 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.79 -33.36 27.3 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.216 -0.927 . . . . 0.0 110.764 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.6 p -50.26 -35.52 27.35 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 120.987 -1.07 . . . . 0.0 110.947 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 77.2 p -110.06 124.47 51.53 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.096 -1.002 . . . . 0.0 109.888 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -116.27 144.58 44.04 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.254 -0.904 . . . . 0.0 110.369 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.536 ' O ' HD21 ' A' ' 60' ' ' LEU . 17.2 mtpp -122.51 146.82 47.05 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.264 -0.898 . . . . 0.0 110.103 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.4 mt 54.54 99.34 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.213 -0.929 . . . . 0.0 110.704 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -112.7 135.25 53.66 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 0.0 109.978 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.0 -173.52 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.039 -1.038 . . . . 0.0 110.547 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.697 ' O ' HG23 ' A' ' 74' ' ' THR . 49.8 tp -113.71 83.26 1.82 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.162 -0.961 . . . . 0.0 110.22 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -170.0 -51.62 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.161 -0.962 . . . . 0.0 111.056 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -49.38 -36.32 21.43 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.113 -0.992 . . . . 0.0 110.796 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.888 HD23 ' CG1' ' A' ' 8' ' ' VAL . 6.3 mp -72.74 150.43 42.87 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.189 -0.944 . . . . 0.0 109.367 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.524 ' O ' HG22 ' A' ' 8' ' ' VAL . 12.9 mm-40 -97.77 136.74 37.68 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.249 -0.907 . . . . 0.0 111.251 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.53 -41.63 1.52 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.46 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 52.9 p-90 -53.96 -35.65 62.01 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.993 -1.298 . . . . 0.0 110.868 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.46 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 15.8 tt0 -68.11 -28.93 67.76 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.111 -0.993 . . . . 0.0 111.035 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -96.38 -34.52 11.51 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 120.826 -1.171 . . . . 0.0 111.251 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.706 HD13 ' CD2' ' A' ' 10' ' ' TYR . 74.4 mt -59.25 -175.3 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.865 -1.147 . . . . 0.0 110.151 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.33 161.63 11.21 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.154 -0.966 . . . . 0.0 110.26 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.2 -45.43 11.33 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.217 -0.927 . . . . 0.0 109.925 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -62.6 -42.45 99.58 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.315 -0.866 . . . . 0.0 109.396 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.422 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 1.1 mp0 -61.57 -40.28 94.16 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.338 -0.851 . . . . 0.0 109.514 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.521 ' CG ' HD21 ' A' ' 73' ' ' LEU . 22.2 ttpt -57.66 -39.57 77.33 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.322 -0.861 . . . . 0.0 109.943 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -60.41 -42.23 95.53 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.206 -0.933 . . . . 0.0 109.637 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -59.81 -35.37 74.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.324 -0.86 . . . . 0.0 110.237 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.568 ' CG2' HD13 ' A' ' 73' ' ' LEU . 37.9 mm -60.33 -38.93 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.492 0 O-C-N 121.109 -0.994 . . . . 0.0 109.634 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 m -58.59 -42.53 88.29 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.02 -1.05 . . . . 0.0 109.795 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -63.35 -40.64 97.84 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.297 -0.877 . . . . 0.0 109.284 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.98 ' CE1' HG22 ' A' ' 53' ' ' ILE . 67.6 t60 -58.39 -41.8 85.7 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.192 -0.942 . . . . 0.0 109.59 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.441 ' CG1' ' CZ ' ' A' ' 57' ' ' PHE . 9.3 mt -69.75 -39.62 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.176 -0.952 . . . . 0.0 108.9 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.89 -38.05 84.32 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.211 -0.931 . . . . 0.0 109.728 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -63.62 -41.48 98.27 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.134 -0.978 . . . . 0.0 109.488 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.446 HD21 ' HB3' ' A' ' 60' ' ' LEU . 5.9 tp -60.7 -35.58 76.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.243 -0.911 . . . . 0.0 110.33 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.1 t -89.93 -39.29 13.1 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.05 -1.031 . . . . 0.0 110.178 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 41.8 t -114.51 106.53 14.38 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.183 -0.948 . . . . 0.0 110.099 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.8 tttp -116.35 135.64 53.69 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.167 -0.958 . . . . 0.0 110.27 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.66 77.6 1.78 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.183 -0.948 . . . . 0.0 110.131 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.44 124.56 15.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.168 -0.958 . . . . 0.0 110.3 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -137.5 46.05 1.03 Allowed Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.504 -1.439 . . . . 0.0 109.504 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 25.3 m -138.89 56.71 9.74 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.183 -1.187 . . . . 0.0 110.176 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.52 129.36 14.62 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.287 1.151 . . . . 0.0 110.338 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -144.42 139.1 28.18 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.203 -0.936 . . . . 0.0 110.299 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -135.81 -65.07 0.6 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.192 -0.943 . . . . 0.0 110.198 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -144.73 -58.82 0.36 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.179 -0.95 . . . . 0.0 110.47 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -134.29 110.11 9.28 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.168 -0.958 . . . . 0.0 110.204 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.7 t -118.29 100.12 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.241 -0.912 . . . . 0.0 109.889 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.1 t -138.11 143.1 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.269 -0.894 . . . . 0.0 110.0 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -117.15 138.88 51.37 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.091 -1.006 . . . . 0.0 110.231 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.26 127.82 54.09 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.21 -0.931 . . . . 0.0 110.234 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 20.1 mtmm -121.27 105.66 10.76 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.167 -0.958 . . . . 0.0 110.185 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.7 mt -120.33 103.67 9.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.206 -0.934 . . . . 0.0 110.206 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.0 p -136.7 118.6 15.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.228 -0.92 . . . . 0.0 110.125 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 117.944 -1.026 . . . . 0.0 110.141 -179.995 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 ttt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.562 ' HB3' ' CG ' ' A' ' 37' ' ' PRO . . . -143.38 -59.68 0.41 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.171 -0.955 . . . . 0.0 110.253 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -128.56 166.09 19.51 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.283 -0.886 . . . . 0.0 110.144 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -118.58 130.22 55.77 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 110.231 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -141.47 125.43 17.17 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.915 . . . . 0.0 110.288 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.443 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 0.9 OUTLIER -117.05 141.56 48.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.17 -0.956 . . . . 0.0 110.052 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' O ' HG23 ' A' ' 32' ' ' ILE . 80.5 m -127.74 156.39 42.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 109.803 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.415 HG23 ' HB3' ' A' ' 76' ' ' LEU . 59.6 t -111.2 120.58 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.128 -0.982 . . . . 0.0 109.927 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -137.95 156.45 47.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.136 -0.978 . . . . 0.0 110.605 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -101.45 154.1 19.11 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.485 -0.76 . . . . 0.0 109.693 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.27 140.76 29.38 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.246 -0.909 . . . . 0.0 110.34 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 tttp -136.03 -58.11 0.76 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.279 -0.888 . . . . 0.0 110.456 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -134.34 99.14 4.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.075 . . . . 0.0 110.316 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.6 138.65 3.35 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 26' ' ' VAL . 76.6 p -124.54 146.35 49.06 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.189 -1.183 . . . . 0.0 109.942 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -163.35 153.93 16.16 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.18 -0.95 . . . . 0.0 111.435 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.77 120.13 8.66 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.475 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 24.5 p -58.92 140.29 55.64 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.184 -1.186 . . . . 0.0 110.21 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 8.0 tptt -94.19 150.73 20.04 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.114 -0.991 . . . . 0.0 110.581 -178.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 13.2 mptt 51.6 48.39 22.97 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.475 ' HB3' ' SG ' ' A' ' 18' ' ' CYS 0.263 10.4 t -165.2 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.861 -0.524 . . . . 0.0 110.485 -175.481 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 21' ' ' CYS . 23.5 tttt 78.12 74.22 0.06 Allowed 'General case' 0 N--CA 1.526 3.342 0 O-C-N 120.947 -1.096 . . . . 0.0 112.492 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.4 tt0 -176.11 -172.88 0.53 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.165 -0.959 . . . . 0.0 110.604 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -120.3 146.16 46.38 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.112 -0.992 . . . . 0.0 109.142 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.9 mt -107.11 141.82 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.058 -1.026 . . . . 0.0 110.477 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.555 ' HA ' HG22 ' A' ' 15' ' ' THR . 59.4 t -141.12 158.04 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.249 -0.907 . . . . 0.0 109.961 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.54 135.97 17.43 Favored 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.287 -0.883 . . . . 0.0 111.089 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.56 8.72 39.81 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.155 -1.021 . . . . 0.0 111.828 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.8 p -127.45 132.79 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-N 119.853 1.827 . . . . 0.0 110.855 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 20.2 t -73.19 143.3 47.25 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.22 -0.925 . . . . 0.0 108.855 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.428 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 11.9 ptt180 -145.47 155.38 43.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.123 -0.986 . . . . 0.0 111.475 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.527 HG23 ' O ' ' A' ' 7' ' ' CYS . 3.8 mt -105.08 145.09 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.449 -0.782 . . . . 0.0 109.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.83 137.69 13.91 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 108.413 -1.875 . . . . 0.0 108.413 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.443 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 19.4 ttpt -117.94 123.75 46.55 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.903 -1.351 . . . . 0.0 110.42 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -96.44 113.09 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.229 -0.919 . . . . 0.0 110.115 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.9 t -120.49 119.13 30.6 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.267 -0.896 . . . . 0.0 109.916 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.562 ' CG ' ' HB3' ' A' ' 2' ' ' ALA . 47.6 Cg_endo -73.35 145.66 38.73 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 O-C-N 123.132 1.07 . . . . 0.0 110.342 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -102.88 146.93 33.31 Favored Pre-proline 0 N--CA 1.5 2.039 0 O-C-N 121.149 -0.97 . . . . 0.0 110.151 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.62 70.25 4.2 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.328 1.173 . . . . 0.0 110.46 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -153.55 -58.88 0.13 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.09 -1.006 . . . . 0.0 110.499 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.3 t -121.26 144.6 48.53 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.245 -0.91 . . . . 0.0 110.157 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -99.39 -22.16 15.68 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.195 -0.94 . . . . 0.0 111.886 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 m -88.77 -40.6 13.09 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.615 -1.303 . . . . 0.0 110.074 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -130.0 66.76 0.57 Allowed Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -136.9 75.98 0.38 Allowed Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -144.22 136.61 26.66 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -1.207 . . . . 0.0 110.268 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ttt -117.04 142.95 46.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.275 -0.891 . . . . 0.0 110.34 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -125.25 120.74 32.09 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.278 -0.889 . . . . 0.0 110.26 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -117.98 149.46 40.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.254 -0.904 . . . . 0.0 109.221 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.428 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 16.9 m95 -91.62 163.2 14.2 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.105 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.447 ' OH ' ' HB2' ' A' ' 20' ' ' LYS . 34.0 m-85 -140.39 173.91 11.04 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.38 -0.825 . . . . 0.0 110.841 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.439 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 11.1 m80 -108.77 -176.92 3.17 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.361 -0.837 . . . . 0.0 109.52 177.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 1.009 HG22 ' CE1' ' A' ' 93' ' ' HIS . 48.7 mm -97.48 -60.45 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -80.1 -43.14 22.25 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.782 -1.199 . . . . 0.0 109.388 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.439 ' HB3' ' CB ' ' A' ' 52' ' ' HIS . 19.3 t -63.12 -27.99 69.76 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.71 178.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -83.2 -54.34 5.09 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.725 -1.234 . . . . 0.0 108.648 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.576 ' HD2' HD22 ' A' ' 97' ' ' LEU . 13.0 m-85 -59.61 -26.55 65.56 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.72 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.71 -38.98 86.89 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.833 -1.167 . . . . 0.0 109.375 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.5 tttm -67.96 -40.65 83.17 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.281 178.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.75 -41.76 96.06 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.239 -0.913 . . . . 0.0 109.081 179.031 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' A' ' 97' ' ' LEU . 8.4 tt0 -56.17 -33.41 65.22 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.245 -0.909 . . . . 0.0 109.695 178.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.3 mtp-105 -103.68 29.87 5.46 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.316 -0.865 . . . . 0.0 110.573 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -113.17 168.42 9.73 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.948 -1.095 . . . . 0.0 110.026 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 -63.18 154.76 30.22 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.173 -0.954 . . . . 0.0 110.137 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.97 -33.92 19.46 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.168 -0.957 . . . . 0.0 110.751 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -49.46 -32.88 12.86 Favored 'General case' 0 N--CA 1.515 2.805 0 O-C-N 120.882 -1.136 . . . . 0.0 111.344 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 35.6 m -104.07 120.06 40.27 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.924 -1.11 . . . . 0.0 110.069 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.3 mmtt -116.82 144.34 44.61 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.202 -0.936 . . . . 0.0 110.267 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.7 mtpt -138.35 154.32 48.96 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.243 -0.91 . . . . 0.0 110.183 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.3 97.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.174 -0.953 . . . . 0.0 110.642 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -114.79 136.2 53.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.147 -0.97 . . . . 0.0 110.333 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.67 -178.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.043 -1.036 . . . . 0.0 110.919 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.787 HD13 ' CG2' ' A' ' 90' ' ' ILE . 62.3 tp -114.4 81.22 1.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.291 -0.881 . . . . 0.0 110.374 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.507 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -172.17 -51.63 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 110.722 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -51.19 -36.77 43.0 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.11 -0.994 . . . . 0.0 110.425 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' A' ' 6' ' ' PHE . 1.4 mp -63.46 152.33 38.68 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.136 -0.978 . . . . 0.0 109.451 179.36 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -102.1 116.29 32.36 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.187 -0.946 . . . . 0.0 110.307 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.08 -36.12 1.77 Allowed Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.909 -1.139 . . . . 0.0 110.467 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -51.53 -32.24 27.12 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.894 -1.357 . . . . 0.0 111.021 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -56.7 -39.87 74.63 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.907 -1.121 . . . . 0.0 110.126 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.61 -41.16 93.04 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.169 -0.957 . . . . 0.0 109.629 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.61 ' CD2' HD11 ' A' ' 90' ' ' ILE . 3.8 mp -47.67 165.55 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.913 0 O-C-N 121.291 -0.881 . . . . 0.0 110.875 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -88.47 161.37 17.05 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.226 -0.921 . . . . 0.0 109.823 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -56.32 -38.27 71.09 Favored 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.15 -0.968 . . . . 0.0 110.687 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -71.89 -40.42 68.91 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.182 -0.949 . . . . 0.0 109.707 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.4 -36.16 65.97 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.222 -0.924 . . . . 0.0 109.346 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.495 ' HG2' HD21 ' A' ' 73' ' ' LEU . 12.7 tttm -69.56 -37.67 77.12 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.117 -0.989 . . . . 0.0 109.625 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.55 -39.49 93.85 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.211 -0.931 . . . . 0.0 109.667 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -59.82 -34.03 72.53 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.787 ' CG2' HD13 ' A' ' 73' ' ' LEU . 96.5 mt -65.01 -39.92 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.02 -1.05 . . . . 0.0 109.571 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 73' ' ' LEU . 73.8 p -61.82 -46.76 88.09 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.063 -1.023 . . . . 0.0 109.354 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -61.66 -38.96 89.69 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.267 -0.896 . . . . 0.0 108.897 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 1.009 ' CE1' HG22 ' A' ' 53' ' ' ILE . 42.1 t60 -57.22 -48.82 77.83 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.238 -0.914 . . . . 0.0 109.737 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.0 mt -69.49 -39.97 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.648 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.73 -35.98 81.51 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.683 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.31 -37.6 85.78 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.576 HD22 ' HD2' ' A' ' 57' ' ' PHE . 4.3 tp -74.93 -40.52 60.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.114 -0.991 . . . . 0.0 110.032 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.0 t -60.99 -44.0 98.04 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.219 -0.926 . . . . 0.0 109.882 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.4 t -144.12 116.54 8.56 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.252 -0.905 . . . . 0.0 110.272 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -116.73 -57.36 2.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.22 -0.925 . . . . 0.0 110.269 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.42 -178.27 4.17 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.159 -0.963 . . . . 0.0 110.236 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.06 53.24 1.95 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.261 -0.899 . . . . 0.0 110.195 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -73.5 -165.18 10.07 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.7 m -135.39 116.85 12.11 Favored Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.21 -1.17 . . . . 0.0 110.133 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.15 156.08 55.92 Favored 'Trans proline' 0 N--CA 1.486 1.038 0 O-C-N 123.144 1.076 . . . . 0.0 110.427 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -118.18 -57.59 2.07 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.275 -0.891 . . . . 0.0 110.121 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 16.1 mmmt -117.34 129.27 55.77 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.168 -0.958 . . . . 0.0 110.132 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.8 mtpt -117.33 -57.17 2.17 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.182 -0.949 . . . . 0.0 110.189 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.87 165.2 13.59 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.183 -0.948 . . . . 0.0 110.143 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 9.1 p -130.48 147.99 33.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.194 -0.941 . . . . 0.0 110.3 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.7 t -116.4 143.09 27.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.204 -0.935 . . . . 0.0 109.941 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -117.27 128.22 54.86 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.156 -0.965 . . . . 0.0 110.185 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.15 141.33 45.92 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.173 -0.954 . . . . 0.0 110.212 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -116.72 98.9 6.77 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.234 -0.916 . . . . 0.0 110.279 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.49 125.57 52.13 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.143 -0.973 . . . . 0.0 110.061 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 43.1 p -118.45 149.28 41.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.139 -0.975 . . . . 0.0 110.187 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.261 179.924 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.3 mtm . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 120.729 0.3 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.38 46.81 1.63 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.168 -0.958 . . . . 0.0 110.174 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -116.32 -56.29 2.31 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.237 -0.915 . . . . 0.0 110.254 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -138.62 134.55 33.88 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.19 -0.944 . . . . 0.0 110.348 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 -136.73 149.67 47.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.153 -0.967 . . . . 0.0 110.143 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.874 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -120.55 149.82 41.83 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.268 -0.895 . . . . 0.0 110.472 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.0 t -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.251 -0.906 . . . . 0.0 109.666 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.767 HG12 HG23 ' A' ' 32' ' ' ILE . 20.0 m -102.79 106.21 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.143 -0.973 . . . . 0.0 110.671 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -118.26 158.95 24.21 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.917 -1.115 . . . . 0.0 110.476 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CD2' HD11 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -101.69 144.4 30.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.49 -0.756 . . . . 0.0 109.819 179.797 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.95 102.04 0.14 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.245 -0.91 . . . . 0.0 109.879 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -123.42 110.81 15.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 0.0 110.167 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 52.94 88.51 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.06 -1.025 . . . . 0.0 110.708 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.16 131.36 2.76 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 69.1 p -129.86 140.63 50.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -1.175 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -159.01 148.6 18.93 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.168 -0.957 . . . . 0.0 111.477 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.0 126.26 38.08 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.232 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.497 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 21.1 p -64.25 126.33 27.41 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.261 -1.14 . . . . 0.0 110.837 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 17.3 mttm -75.59 156.71 34.7 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.87 15.07 10.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.974 -1.079 . . . . 0.0 111.492 -178.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.401 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 8.2 p -175.51 151.44 1.21 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.555 -1.341 . . . . 0.0 110.602 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.63 90.48 8.27 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.989 -1.069 . . . . 0.0 111.731 -177.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.426 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.3 tt0 -168.88 -175.13 2.27 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.257 -0.902 . . . . 0.0 110.64 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.34 153.59 46.87 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.082 -1.011 . . . . 0.0 109.395 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.518 HG21 ' HD3' ' A' ' 31' ' ' ARG . 79.5 mt -106.28 111.29 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.218 -0.926 . . . . 0.0 110.111 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.523 ' O ' HG12 ' A' ' 29' ' ' VAL . 57.5 t -114.19 158.92 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.012 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.4 ' HG3' HG12 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -50.08 133.22 23.28 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.245 -0.909 . . . . 0.0 111.0 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 105.17 6.12 39.72 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 120.163 -1.017 . . . . 0.0 111.754 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.523 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.9 p -127.05 135.86 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 119.77 1.785 . . . . 0.0 110.476 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.427 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 8.2 t -87.72 140.61 29.34 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.115 -0.99 . . . . 0.0 109.975 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.518 ' HD3' HG21 ' A' ' 25' ' ' ILE . 13.0 ptt-85 -135.07 144.31 47.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.198 -0.939 . . . . 0.0 110.324 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.767 HG23 HG12 ' A' ' 8' ' ' VAL . 19.0 mt -108.82 122.56 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 109.351 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.18 162.44 15.24 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.454 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 12.3 pttp -127.86 140.9 51.74 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.277 -1.131 . . . . 0.0 109.405 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 46' ' ' ASP . 60.2 t -109.34 109.18 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.972 -1.08 . . . . 0.0 110.14 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.2 t -121.12 112.62 33.12 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.211 -0.93 . . . . 0.0 109.915 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.96 137.15 26.19 Favored 'Trans proline' 0 N--CA 1.486 1.059 0 O-C-N 123.118 1.062 . . . . 0.0 110.356 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -103.78 117.96 58.49 Favored Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -74.14 71.76 4.26 Favored 'Trans proline' 0 N--CA 1.484 0.934 0 O-C-N 123.098 1.052 . . . . 0.0 110.332 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -146.71 -58.8 0.29 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.092 -1.005 . . . . 0.0 110.445 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.5 m -107.5 157.64 17.85 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.113 -0.992 . . . . 0.0 110.182 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -95.27 -38.95 10.31 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.191 -0.943 . . . . 0.0 110.376 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 27.2 t -56.7 -39.74 74.38 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.062 -1.024 . . . . 0.0 110.163 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -85.83 101.46 2.58 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.84 -80.19 0.38 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.407 ' HB3' HG13 ' A' ' 35' ' ' VAL . 0.7 OUTLIER -126.96 149.62 49.76 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.114 -1.227 . . . . 0.0 110.36 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.9 mtt -113.81 135.4 54.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.273 -0.892 . . . . 0.0 110.123 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.435 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 22.3 ttmt -121.75 135.37 54.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.17 -0.956 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -113.09 145.25 41.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.163 -0.96 . . . . 0.0 109.598 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.435 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 11.9 m95 -104.14 112.24 25.16 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.052 -1.03 . . . . 0.0 111.074 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -124.13 173.68 8.14 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.399 176.945 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.497 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.8 m80 -93.41 177.66 5.96 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.475 -0.766 . . . . 0.0 110.693 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.569 HG22 ' CE1' ' A' ' 93' ' ' HIS . 30.3 mt -77.24 -54.83 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -57.46 -38.03 73.82 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.032 -1.042 . . . . 0.0 109.695 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 18.8 m -62.3 -50.15 72.79 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.133 -0.979 . . . . 0.0 109.085 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.556 ' SD ' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -70.43 -44.83 67.09 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.388 -0.82 . . . . 0.0 109.522 179.648 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 53' ' ' ILE . 11.4 m-85 -64.47 -29.52 70.56 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.613 179.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -62.21 -42.05 98.94 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.854 -1.154 . . . . 0.0 109.091 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.4 -40.84 73.68 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.734 178.52 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.556 HD13 ' SD ' ' A' ' 56' ' ' MET . 0.3 OUTLIER -60.42 -41.88 94.88 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.262 -0.899 . . . . 0.0 108.882 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -60.11 -35.09 74.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.474 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.72 31.56 5.18 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.264 -0.897 . . . . 0.0 110.558 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -106.9 166.91 10.25 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.85 -1.156 . . . . 0.0 110.1 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.5 mtp180 -65.07 155.38 34.94 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.2 -0.938 . . . . 0.0 110.143 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.78 3.15 46.33 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.273 -0.892 . . . . 0.0 112.086 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -84.37 -34.79 23.53 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.547 -1.346 . . . . 0.0 110.699 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.31 135.42 43.93 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.074 -1.016 . . . . 0.0 110.193 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.0 mmmt -115.21 144.35 43.84 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.188 -0.945 . . . . 0.0 110.22 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -134.87 143.15 46.82 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.223 -0.923 . . . . 0.0 110.265 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.2 mt 54.86 101.02 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.172 -0.955 . . . . 0.0 110.782 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.23 135.6 44.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.144 -0.973 . . . . 0.0 109.452 179.171 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 54.64 -162.75 0.13 Allowed 'General case' 0 N--CA 1.502 2.138 0 O-C-N 120.944 -1.098 . . . . 0.0 109.977 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.615 HD13 ' OG1' ' A' ' 91' ' ' THR . 0.7 OUTLIER -132.48 39.08 3.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.022 -1.049 . . . . 0.0 110.602 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.03 35.87 0.84 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.206 -0.934 . . . . 0.0 110.481 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -133.65 37.26 3.3 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.099 -1.001 . . . . 0.0 109.923 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.874 HD22 ' HB3' ' A' ' 6' ' ' PHE . 96.5 mt -136.35 152.73 50.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.228 -0.92 . . . . 0.0 109.75 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -81.16 110.31 16.54 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.069 -1.019 . . . . 0.0 110.097 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.31 -34.75 1.61 Allowed Glycine 0 N--CA 1.494 2.544 0 C-N-CA 119.691 -1.242 . . . . 0.0 111.073 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.409 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 20.2 p-90 -63.95 -31.11 72.18 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.12 1.46 . . . . 0.0 110.759 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.0 tt0 -52.88 -35.17 57.52 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.829 -1.17 . . . . 0.0 110.596 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -82.64 -33.37 27.87 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.031 -1.043 . . . . 0.0 110.291 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.434 HD11 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -51.26 176.68 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.872 0 O-C-N 120.916 -1.115 . . . . 0.0 110.555 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -104.22 160.83 14.55 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.123 -0.986 . . . . 0.0 110.416 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.94 -43.33 95.06 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.197 -0.939 . . . . 0.0 110.313 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -61.62 -50.76 71.28 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.701 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.25 -38.59 89.84 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.481 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.811 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.3 ttpm? -60.52 -38.66 85.11 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.219 -0.926 . . . . 0.0 109.727 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -57.64 -38.19 74.63 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.195 -0.941 . . . . 0.0 110.049 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.26 -38.32 76.68 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.086 -1.009 . . . . 0.0 110.255 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.811 HD12 ' HA ' ' A' ' 87' ' ' LYS . 9.3 mt -64.66 -39.34 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 121.047 -1.033 . . . . 0.0 109.352 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.615 ' OG1' HD13 ' A' ' 73' ' ' LEU . 33.6 m -57.35 -39.54 76.14 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -56.86 -39.11 73.7 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.206 -0.934 . . . . 0.0 109.837 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.569 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.7 m-70 -61.9 -54.27 44.33 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.235 -0.916 . . . . 0.0 109.642 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.448 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.5 mp -62.77 -38.38 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.273 -0.971 . . . . 0.0 109.218 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -38.48 89.02 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.241 -0.912 . . . . 0.0 109.766 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -60.77 -46.67 89.56 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 109.541 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.7 mp -59.25 -35.12 73.12 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.271 -0.893 . . . . 0.0 110.014 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.0 m -102.41 69.64 1.12 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.16 -0.963 . . . . 0.0 110.169 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.443 ' OG ' ' N ' ' A' ' 100' ' ' LYS . 16.0 t -106.55 -165.32 1.07 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.094 -1.004 . . . . 0.0 110.04 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.443 ' N ' ' OG ' ' A' ' 99' ' ' SER . 0.4 OUTLIER -115.28 -58.78 2.09 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.11 -0.994 . . . . 0.0 110.498 -179.812 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -150.15 136.82 19.14 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.114 -0.991 . . . . 0.0 110.662 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.01 84.71 1.6 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.184 -0.947 . . . . 0.0 110.408 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -128.15 -172.71 13.27 Favored Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 7.6 p -132.29 148.92 71.63 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.143 -1.21 . . . . 0.0 110.261 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.14 85.66 1.2 Allowed 'Trans proline' 0 C--N 1.316 -1.135 0 O-C-N 123.383 1.202 . . . . 0.0 110.457 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -142.6 162.93 34.2 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.193 -0.942 . . . . 0.0 110.27 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -116.81 -63.42 1.45 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.253 -0.904 . . . . 0.0 110.146 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -130.91 167.15 19.45 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.224 -0.922 . . . . 0.0 110.229 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.41 161.39 19.63 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.216 -0.928 . . . . 0.0 110.139 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 7.6 p -130.38 149.36 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.245 -0.909 . . . . 0.0 110.252 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.6 m -138.01 144.5 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.249 -0.907 . . . . 0.0 110.365 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -133.13 88.52 2.51 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.1 -1.0 . . . . 0.0 110.181 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.58 127.47 50.95 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.196 -0.94 . . . . 0.0 110.225 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -120.15 100.48 7.22 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.168 -0.958 . . . . 0.0 110.277 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.3 mt -116.58 128.4 55.37 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.219 -0.926 . . . . 0.0 110.19 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -139.06 98.15 3.46 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.227 -0.921 . . . . 0.0 110.227 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.169 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttp . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.53 70.69 1.37 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.151 -0.968 . . . . 0.0 110.342 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -120.67 -58.18 1.85 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.11 -0.994 . . . . 0.0 110.084 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -129.41 109.32 10.98 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.194 -0.941 . . . . 0.0 110.023 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -139.38 139.14 37.09 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.17 -0.956 . . . . 0.0 110.337 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.574 ' HE2' ' HH ' ' A' ' 51' ' ' TYR . 2.0 m-85 -115.98 146.63 41.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.254 -0.904 . . . . 0.0 109.999 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.4 m -130.16 159.59 36.36 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.218 -0.926 . . . . 0.0 109.189 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.867 ' CG1' HD23 ' A' ' 76' ' ' LEU . 22.8 m -125.69 105.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.019 -1.051 . . . . 0.0 111.061 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -100.44 141.74 32.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.949 -1.095 . . . . 0.0 109.576 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.465 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 46.8 m-85 -103.99 133.57 48.72 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.22 -0.925 . . . . 0.0 109.721 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.14 133.41 54.99 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -118.25 -58.28 2.0 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -153.68 39.23 0.48 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.168 -0.958 . . . . 0.0 110.642 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -139.25 171.63 23.59 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 m -145.08 127.25 15.69 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.198 -1.177 . . . . 0.0 110.476 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -149.17 143.83 26.2 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.206 -0.934 . . . . 0.0 110.813 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.19 128.0 44.78 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 108.749 -1.74 . . . . 0.0 108.749 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.463 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 32.0 p -64.35 122.55 16.96 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.222 -1.163 . . . . 0.0 110.811 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -68.34 157.25 36.09 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.349 -0.844 . . . . 0.0 108.838 179.69 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 15.79 10.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.842 -1.161 . . . . 0.0 111.83 -179.035 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.405 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 7.9 p -175.29 150.09 1.11 Allowed 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.566 -1.334 . . . . 0.0 110.699 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -86.85 89.13 7.86 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.008 -1.058 . . . . 0.0 111.784 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -165.66 -173.34 2.7 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.308 -0.87 . . . . 0.0 110.409 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -130.32 149.75 51.87 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.014 -1.054 . . . . 0.0 109.499 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.566 HG21 HH21 ' A' ' 31' ' ' ARG . 56.5 mt -102.7 134.35 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.263 -0.898 . . . . 0.0 110.006 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.9 m -136.6 169.2 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.267 -0.896 . . . . 0.0 110.322 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.19 127.33 10.44 Favored 'General case' 0 N--CA 1.516 2.857 0 O-C-N 121.583 -0.698 . . . . 0.0 110.948 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.53 8.81 48.58 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.097 -1.049 . . . . 0.0 111.156 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.1 t -111.2 135.65 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.547 1.673 . . . . 0.0 110.014 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.7 t -91.44 123.06 34.58 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.302 -0.874 . . . . 0.0 108.679 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.566 HH21 HG21 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -106.95 133.82 51.03 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.16 -0.963 . . . . 0.0 110.652 -179.351 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.782 HD11 HG12 ' A' ' 53' ' ' ILE . 6.2 mt -106.47 113.1 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.02 135.54 12.2 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 119.723 -1.227 . . . . 0.0 110.361 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.4 ttpm? -111.99 123.93 51.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -1.07 . . . . 0.0 108.986 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.593 HG22 ' HB3' ' A' ' 48' ' ' LYS . 52.2 t -109.29 108.99 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.132 -0.98 . . . . 0.0 110.272 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.402 HG13 ' HG2' ' A' ' 34' ' ' LYS . 33.2 m -123.6 146.94 51.59 Favored Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.215 -0.928 . . . . 0.0 110.24 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.87 146.25 33.0 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.393 1.207 . . . . 0.0 110.173 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -102.95 116.42 62.52 Favored Pre-proline 0 N--CA 1.499 1.996 0 O-C-N 121.176 -0.953 . . . . 0.0 110.227 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -75.16 -171.27 0.95 Allowed 'Trans proline' 0 C--N 1.32 -0.963 0 O-C-N 123.192 1.101 . . . . 0.0 110.302 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 69.2 t80 63.06 -68.41 0.08 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.492 -0.755 . . . . 0.0 111.614 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.8 t -76.53 152.01 36.17 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.74 -1.225 . . . . 0.0 110.05 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.68 -47.12 4.73 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.242 -0.911 . . . . 0.0 110.408 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.5 t -57.26 -39.3 75.32 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.027 -1.045 . . . . 0.0 110.374 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.07 118.18 7.91 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.1 -85.25 1.72 Allowed Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -129.36 144.79 51.38 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.23 -1.159 . . . . 0.0 110.112 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 tpt -117.9 146.22 44.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.167 -0.958 . . . . 0.0 110.766 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.593 ' HB3' HG22 ' A' ' 35' ' ' VAL . 16.3 ptpt -131.87 144.78 51.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.24 -0.913 . . . . 0.0 109.671 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -135.56 145.37 46.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.037 -1.04 . . . . 0.0 110.45 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -97.85 115.86 28.91 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.166 -0.959 . . . . 0.0 110.53 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.574 ' HH ' ' HE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.8 171.36 11.29 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.073 -1.017 . . . . 0.0 109.989 177.859 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.463 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 63.0 m80 -88.44 163.04 16.16 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.782 HG12 HD11 ' A' ' 32' ' ' ILE . 33.4 mt -67.6 -48.12 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -61.14 -40.75 95.0 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.163 -0.961 . . . . 0.0 109.334 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.405 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 35.6 m -64.1 -44.64 91.7 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.268 179.171 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.491 ' CE ' HD12 ' A' ' 70' ' ' ILE . 5.5 ttp -72.44 -43.26 64.03 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.429 -0.795 . . . . 0.0 109.993 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.477 ' CD2' HG23 ' A' ' 53' ' ' ILE . 16.1 m-85 -71.86 -29.75 64.7 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.794 179.321 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -78.5 -39.5 38.04 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 120.787 -1.195 . . . . 0.0 109.244 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -73.2 -35.78 66.41 Favored 'General case' 0 N--CA 1.505 2.28 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.367 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 tp -73.37 -40.03 64.69 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.229 -0.919 . . . . 0.0 109.409 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.428 ' OE2' HD12 ' A' ' 97' ' ' LEU . 19.6 mt-10 -69.85 -27.46 64.86 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.061 -1.025 . . . . 0.0 110.349 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.22 -36.3 10.08 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.917 -1.114 . . . . 0.0 110.966 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.14 151.43 50.69 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.956 -1.09 . . . . 0.0 111.075 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.48 104.14 9.75 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.266 -0.896 . . . . 0.0 109.702 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -87.27 -36.07 18.12 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.082 -1.011 . . . . 0.0 110.792 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.404 HG23 ' HG3' ' A' ' 68' ' ' LYS . 8.4 t -144.09 -163.61 1.71 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.039 -1.038 . . . . 0.0 110.265 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 16.0 m -102.62 105.23 15.68 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.123 -0.985 . . . . 0.0 110.116 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HG3' HG23 ' A' ' 66' ' ' THR . 18.5 mtpt -118.25 143.4 46.59 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.172 -0.955 . . . . 0.0 110.065 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -130.61 99.41 4.96 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.218 -0.926 . . . . 0.0 110.374 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.491 HD12 ' CE ' ' A' ' 56' ' ' MET . 76.0 mt -114.59 99.01 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.237 -0.914 . . . . 0.0 109.814 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -108.84 132.91 53.56 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.293 -0.879 . . . . 0.0 109.801 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 51.24 -165.37 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.094 -1.004 . . . . 0.0 110.493 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.862 HD13 HG21 ' A' ' 90' ' ' ILE . 54.0 tp -122.0 84.22 2.22 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.102 -0.999 . . . . 0.0 110.032 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.469 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.5 OUTLIER -155.72 -54.85 0.09 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.236 -0.915 . . . . 0.0 110.964 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -47.73 -32.71 6.13 Favored 'General case' 0 N--CA 1.518 2.948 0 O-C-N 121.074 -1.016 . . . . 0.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.867 HD23 ' CG1' ' A' ' 8' ' ' VAL . 7.4 mp -72.69 153.18 41.31 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.054 -1.029 . . . . 0.0 110.218 179.67 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.541 ' O ' HG22 ' A' ' 8' ' ' VAL . 46.8 tt0 -99.65 136.46 39.55 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.266 -0.896 . . . . 0.0 110.697 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.514 ' O ' HD12 ' A' ' 82' ' ' LEU . . . 129.33 -35.07 2.66 Favored Glycine 0 N--CA 1.494 2.563 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 44.3 p-90 -67.29 -15.36 63.65 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 120.923 -1.34 . . . . 0.0 112.123 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -51.19 -37.67 47.94 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.556 -1.34 . . . . 0.0 111.356 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -169.3 54.89 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 120.979 -1.076 . . . . 0.0 112.071 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 78' ' ' GLY . 14.0 mt -111.4 -70.36 0.82 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 109.926 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -122.49 131.17 53.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.072 -1.017 . . . . 0.0 110.133 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -88.16 -50.68 6.22 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.081 -1.012 . . . . 0.0 109.966 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -66.55 -41.74 88.19 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.971 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.381 178.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.865 ' HA ' HD12 ' A' ' 90' ' ' ILE . 35.1 tttt -58.09 -38.93 77.35 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.117 -0.989 . . . . 0.0 109.879 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 2.8 tm-20 -60.93 -40.34 92.85 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.244 -0.91 . . . . 0.0 109.794 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.77 92.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.13 -0.981 . . . . 0.0 110.101 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.865 HD12 ' HA ' ' A' ' 87' ' ' LYS . 11.3 mt -62.19 -40.42 87.55 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 121.191 -0.943 . . . . 0.0 109.746 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 67.3 p -61.51 -39.13 89.87 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.123 -0.986 . . . . 0.0 109.94 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -58.88 -39.87 82.67 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.179 -0.951 . . . . 0.0 109.962 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.552 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.8 m-70 -58.6 -46.15 87.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.171 -0.956 . . . . 0.0 110.163 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.0 mp -61.96 -41.56 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.169 -0.957 . . . . 0.0 108.927 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.34 83.04 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.499 -0.881 . . . . 0.0 109.926 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -71.6 -38.31 70.86 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.136 -0.978 . . . . 0.0 109.81 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.428 HD12 ' OE2' ' A' ' 61' ' ' GLU . 38.0 tp -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.123 -0.985 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 39.5 t -91.89 -40.68 11.03 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.973 -1.079 . . . . 0.0 110.034 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.62 155.82 30.29 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.186 -0.946 . . . . 0.0 110.115 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -131.82 43.2 3.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.132 -0.98 . . . . 0.0 110.22 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 52.7 75.56 0.23 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.048 -1.033 . . . . 0.0 110.761 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -128.09 80.18 1.94 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.18 -0.95 . . . . 0.0 110.202 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -125.09 83.64 0.35 Allowed Glycine 0 N--CA 1.493 2.489 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.9 p -130.69 84.38 58.97 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.182 -1.187 . . . . 0.0 110.226 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.16 75.26 2.86 Favored 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.419 1.221 . . . . 0.0 110.346 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -138.13 46.12 2.07 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.146 -0.971 . . . . 0.0 110.297 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -131.47 105.58 7.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.241 -0.912 . . . . 0.0 110.006 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -116.41 -56.47 2.29 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.217 -0.927 . . . . 0.0 110.327 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.09 136.87 52.67 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.214 -0.928 . . . . 0.0 110.164 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 34.0 m -130.45 147.59 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.193 -0.942 . . . . 0.0 110.355 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.5 t -138.39 143.3 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.185 -0.947 . . . . 0.0 110.06 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -117.63 91.54 3.6 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.198 -0.939 . . . . 0.0 110.29 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -122.91 135.44 54.5 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.259 -0.9 . . . . 0.0 110.239 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 28.6 mtmt -123.78 144.8 49.47 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.282 -0.886 . . . . 0.0 110.247 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.7 tp -123.6 140.51 52.93 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.229 -0.919 . . . . 0.0 110.207 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 29.6 p -119.31 119.36 33.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.21 -0.931 . . . . 0.0 110.164 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.8 m . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 118.043 -0.979 . . . . 0.0 110.214 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 mmt . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 120.754 0.312 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.01 166.39 24.93 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.129 -0.982 . . . . 0.0 110.182 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -131.95 40.41 3.36 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.225 -0.922 . . . . 0.0 110.228 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -132.2 152.76 51.15 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.286 -0.884 . . . . 0.0 110.143 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -142.36 145.79 34.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.218 -0.926 . . . . 0.0 110.381 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.778 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -116.69 147.04 42.34 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.193 -0.942 . . . . 0.0 110.202 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.8 t -128.01 148.24 50.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.329 -0.857 . . . . 0.0 108.884 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.841 HG12 HG23 ' A' ' 32' ' ' ILE . 16.9 m -128.82 109.47 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.063 -1.023 . . . . 0.0 110.824 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -123.47 161.46 24.81 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.11 -0.994 . . . . 0.0 110.69 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -102.39 155.64 18.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.495 -0.753 . . . . 0.0 110.072 179.901 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.33 140.01 30.35 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.357 -0.839 . . . . 0.0 110.019 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.3 mttm -114.88 -62.36 1.61 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.149 -0.97 . . . . 0.0 110.269 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -139.35 39.61 2.08 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.255 -0.903 . . . . 0.0 110.335 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.25 124.7 2.59 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.856 HG22 ' HA ' ' A' ' 26' ' ' VAL . 77.3 p -113.75 146.03 40.49 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.198 -1.178 . . . . 0.0 110.163 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -158.15 147.87 19.85 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.227 -0.921 . . . . 0.0 111.175 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.92 121.39 18.49 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 108.761 -1.735 . . . . 0.0 108.761 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.483 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 27.0 p -63.93 123.34 18.73 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.306 -1.114 . . . . 0.0 110.897 -178.326 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 46.8 mttt -71.59 156.05 39.84 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.577 -0.702 . . . . 0.0 109.256 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 65.51 16.01 10.31 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.875 -1.141 . . . . 0.0 111.638 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.0 p -174.74 150.48 1.32 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.592 -1.318 . . . . 0.0 110.534 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.5 92.28 9.12 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.476 -178.138 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.433 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.65 -174.68 2.55 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 110.667 179.243 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -131.63 153.3 50.08 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.105 -0.997 . . . . 0.0 109.228 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.898 HG21 ' HD3' ' A' ' 31' ' ' ARG . 80.8 mt -107.91 139.28 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.195 -0.94 . . . . 0.0 110.592 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.856 ' HA ' HG22 ' A' ' 15' ' ' THR . 58.1 t -137.58 161.46 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.435 -0.791 . . . . 0.0 109.477 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -47.35 130.06 13.17 Favored 'General case' 0 N--CA 1.517 2.899 0 O-C-N 121.318 -0.864 . . . . 0.0 111.187 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 106.37 8.47 33.12 Favored Glycine 0 N--CA 1.496 2.667 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.992 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.684 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.8 p -124.38 136.09 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 CA-C-N 119.909 1.855 . . . . 0.0 110.441 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.7 t -83.67 141.84 31.2 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.187 -0.946 . . . . 0.0 109.959 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.898 ' HD3' HG21 ' A' ' 25' ' ' ILE . 27.7 mtm180 -119.47 146.6 45.27 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.148 -0.97 . . . . 0.0 110.743 -179.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.841 HG23 HG12 ' A' ' 8' ' ' VAL . 5.4 mt -121.22 111.26 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.74 137.94 13.66 Favored Glycine 0 N--CA 1.494 2.54 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.116 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 6' ' ' PHE . 74.2 tttt -108.0 125.32 51.39 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.333 -1.098 . . . . 0.0 109.174 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.4 HG22 ' HB3' ' A' ' 48' ' ' LYS . 55.9 t -101.15 115.15 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.129 -0.982 . . . . 0.0 110.193 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.6 t -117.22 113.55 39.1 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.245 -0.909 . . . . 0.0 109.812 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.6 148.66 53.88 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 123.201 1.106 . . . . 0.0 110.481 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -103.09 165.36 13.75 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.31 -38.78 8.28 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.439 1.231 . . . . 0.0 110.26 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -109.45 154.04 23.18 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.179 -0.951 . . . . 0.0 109.729 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.401 ' O ' ' OG ' ' A' ' 41' ' ' SER . 25.9 p -115.62 103.42 10.7 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.201 -0.937 . . . . 0.0 110.465 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -103.05 -66.93 0.91 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.205 -0.934 . . . . 0.0 110.064 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.29 -43.59 10.27 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.171 -0.956 . . . . 0.0 110.171 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -145.38 -75.34 0.02 OUTLIER Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.846 -1.302 . . . . 0.0 109.846 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 141.21 -45.16 0.98 Allowed Glycine 0 N--CA 1.494 2.519 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.17 127.2 55.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.213 -1.169 . . . . 0.0 110.033 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 54.8 ttp -117.42 147.58 42.56 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.147 -0.971 . . . . 0.0 110.545 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HB3' HG22 ' A' ' 35' ' ' VAL . 11.8 pttm -131.3 143.77 50.78 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 109.857 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -120.43 136.23 54.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.155 -0.966 . . . . 0.0 110.026 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -91.89 112.95 25.08 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.052 -1.03 . . . . 0.0 110.362 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.516 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -125.91 172.05 10.22 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.889 177.494 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.483 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 66.4 m80 -89.63 172.61 8.83 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 119.792 -0.763 . . . . 0.0 110.681 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.527 HG22 ' CE1' ' A' ' 93' ' ' HIS . 37.4 mt -72.83 -53.51 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.65 -39.35 80.33 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.011 -1.056 . . . . 0.0 109.838 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.8 m -62.73 -46.65 87.09 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.116 -0.99 . . . . 0.0 109.486 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.453 ' O ' HD13 ' A' ' 60' ' ' LEU . 12.4 tpt -74.25 -42.75 59.15 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.285 -0.885 . . . . 0.0 109.933 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.525 ' CD2' HG23 ' A' ' 53' ' ' ILE . 20.6 m-85 -70.16 -25.9 63.67 Favored 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 119.214 -0.994 . . . . 0.0 110.044 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -73.74 -38.73 64.65 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.741 -1.224 . . . . 0.0 109.358 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -63.73 -41.82 97.99 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.123 -0.986 . . . . 0.0 109.411 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 56' ' ' MET . 7.4 mp -59.97 -41.09 91.23 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.357 -0.84 . . . . 0.0 109.826 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -66.32 -35.19 79.75 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.25 -0.906 . . . . 0.0 110.496 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -79.78 -36.77 36.64 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.089 -1.007 . . . . 0.0 110.237 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.8 129.08 56.56 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.09 -1.006 . . . . 0.0 110.117 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.6 tpt85 -114.39 102.02 9.7 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.166 -0.959 . . . . 0.0 110.216 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.61 3.24 53.21 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.241 -0.912 . . . . 0.0 111.983 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 m 55.72 37.61 29.08 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.414 -1.429 . . . . 0.0 110.421 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -116.89 160.94 20.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.194 -0.941 . . . . 0.0 110.008 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.3 mmmm -101.39 95.54 6.57 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.176 -0.953 . . . . 0.0 110.075 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -125.05 142.4 51.51 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.226 -0.921 . . . . 0.0 110.041 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.3 mt 53.17 92.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.036 -1.04 . . . . 0.0 110.319 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -110.57 136.74 49.23 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.194 -0.941 . . . . 0.0 110.022 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.33 -167.09 0.07 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.03 -1.044 . . . . 0.0 110.464 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 1.105 HD22 HG23 ' A' ' 91' ' ' THR . 14.9 tp -117.02 38.56 3.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.194 -0.941 . . . . 0.0 110.791 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.23 37.11 0.84 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.164 -0.96 . . . . 0.0 110.535 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -131.64 37.32 3.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.206 -0.934 . . . . 0.0 109.894 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.778 HD22 ' HB3' ' A' ' 6' ' ' PHE . 92.0 mt -140.43 152.95 46.1 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.186 -0.947 . . . . 0.0 109.79 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -84.69 98.85 10.45 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.159 -0.963 . . . . 0.0 110.186 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 153.45 -36.19 0.75 Allowed Glycine 0 N--CA 1.495 2.615 0 C-N-CA 119.65 -1.262 . . . . 0.0 110.99 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.404 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 27.4 p-90 -57.94 -29.79 65.44 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 120.928 -1.336 . . . . 0.0 111.029 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -52.41 -36.72 54.9 Favored 'General case' 0 N--CA 1.515 2.794 0 O-C-N 120.861 -1.15 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.59 -33.06 41.96 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.161 -0.962 . . . . 0.0 110.243 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.06 170.3 0.02 OUTLIER 'General case' 0 N--CA 1.518 2.94 0 O-C-N 121.024 -1.048 . . . . 0.0 110.934 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -107.56 161.13 15.12 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.177 -0.952 . . . . 0.0 110.515 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.92 -42.72 90.34 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.214 -0.929 . . . . 0.0 110.258 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -61.79 -51.94 66.24 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.264 -0.898 . . . . 0.0 109.483 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.402 ' OE2' ' CZ ' ' A' ' 10' ' ' TYR . 40.8 mt-10 -63.72 -40.0 95.67 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.006 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.548 ' HA ' HD12 ' A' ' 90' ' ' ILE . 13.3 ttpt -59.43 -38.35 80.46 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.351 -0.843 . . . . 0.0 109.845 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -63.21 -36.61 84.2 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.185 -0.947 . . . . 0.0 110.151 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -68.93 -38.29 79.4 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.07 -1.019 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.548 ' CG2' HD11 ' A' ' 73' ' ' LEU . 9.3 mt -68.74 -38.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.409 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' THR . . . . . 1.105 HG23 HD22 ' A' ' 73' ' ' LEU . 1.8 p -59.01 -37.71 77.55 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.946 -1.096 . . . . 0.0 109.521 178.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -56.4 -37.8 70.64 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.22 -0.925 . . . . 0.0 109.814 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.527 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.61 -54.35 48.09 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.125 -0.984 . . . . 0.0 109.711 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.453 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 9.4 mt -64.79 -39.34 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 C-N-CA 119.399 -0.92 . . . . 0.0 108.984 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.64 87.14 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.409 -0.916 . . . . 0.0 109.504 178.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.6 -49.23 77.42 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.075 -1.016 . . . . 0.0 109.341 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.65 -36.46 78.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.265 -0.897 . . . . 0.0 109.971 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.7 t -103.46 69.54 1.0 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.142 -0.973 . . . . 0.0 110.086 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.6 p -119.22 -172.3 2.28 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.0 110.162 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.1 mtpt -135.65 -179.06 5.42 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.205 -0.934 . . . . 0.0 110.167 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.48 40.26 3.78 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.225 -0.922 . . . . 0.0 110.238 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.99 111.92 11.94 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.242 -0.911 . . . . 0.0 110.233 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -68.29 -124.32 0.03 OUTLIER Glycine 0 N--CA 1.493 2.495 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 p -130.06 91.66 38.71 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.315 -1.109 . . . . 0.0 110.249 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.77 167.24 27.75 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.401 1.211 . . . . 0.0 110.374 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -135.73 102.37 5.06 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.179 -0.951 . . . . 0.0 110.225 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 30.3 mtpt -127.35 176.04 7.74 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.221 -0.924 . . . . 0.0 110.226 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -118.45 82.17 1.8 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.221 -0.924 . . . . 0.0 110.195 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -122.93 161.17 24.68 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.206 -0.934 . . . . 0.0 110.233 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.4 t -125.6 116.93 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.181 -0.95 . . . . 0.0 110.012 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.9 t -117.34 132.72 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.248 -0.907 . . . . 0.0 109.941 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -122.83 110.84 15.94 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.231 -0.918 . . . . 0.0 110.17 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -119.73 116.21 25.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.078 -1.014 . . . . 0.0 110.233 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 12.2 tttt -122.69 141.91 51.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.197 -0.94 . . . . 0.0 110.159 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.8 mt -126.02 149.67 48.67 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.246 -0.908 . . . . 0.0 110.291 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -119.86 134.12 55.35 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 61.8 m . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.245 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -133.41 -165.51 1.63 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.202 -0.936 . . . . 0.0 110.246 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -120.88 104.46 9.86 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.215 -0.928 . . . . 0.0 110.191 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -117.24 139.24 51.04 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.205 -0.934 . . . . 0.0 110.196 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.8 ttt85 -142.24 144.88 33.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.122 -0.986 . . . . 0.0 110.349 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.829 ' HB3' HD22 ' A' ' 76' ' ' LEU . 2.1 m-85 -117.71 140.58 49.48 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.206 -0.934 . . . . 0.0 110.203 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.3 t -130.97 125.51 33.57 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.172 -0.955 . . . . 0.0 109.372 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 1.079 HG12 HG23 ' A' ' 32' ' ' ILE . 11.1 m -103.66 134.23 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.135 -0.978 . . . . 0.0 110.352 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.32 108.11 5.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.195 -0.94 . . . . 0.0 110.318 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.772 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -51.02 157.47 0.84 Allowed 'General case' 0 N--CA 1.514 2.752 0 O-C-N 121.135 -0.978 . . . . 0.0 110.528 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.514 ' HB1' ' H ' ' A' ' 27' ' ' LYS . . . -83.44 139.99 32.63 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.306 -0.872 . . . . 0.0 110.002 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -127.46 -58.47 1.26 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.222 -0.924 . . . . 0.0 110.501 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.22 140.53 26.64 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.17 -0.956 . . . . 0.0 110.328 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.31 149.14 16.73 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -116.07 128.52 55.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.19 -1.183 . . . . 0.0 109.938 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.43 131.38 29.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.125 -0.985 . . . . 0.0 110.948 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.6 124.02 35.07 Favored Glycine 0 N--CA 1.493 2.495 0 N-CA-C 108.284 -1.927 . . . . 0.0 108.284 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 22.3 p -64.93 125.78 25.93 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.181 -1.188 . . . . 0.0 111.005 -178.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 157.38 37.26 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.667 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 16.8 10.71 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.878 -1.139 . . . . 0.0 111.395 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.6 p -177.75 152.42 0.78 Allowed 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.564 -1.335 . . . . 0.0 110.548 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -89.57 92.12 8.96 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.992 -1.067 . . . . 0.0 111.541 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.431 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.93 -173.61 2.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.401 -0.812 . . . . 0.0 110.325 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -139.19 148.99 43.89 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.014 -1.054 . . . . 0.0 109.911 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.45 ' CG2' ' HB2' ' A' ' 11' ' ' ALA . 6.9 mt -112.25 131.0 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.174 -0.954 . . . . 0.0 109.7 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.62 ' O ' HG13 ' A' ' 26' ' ' VAL . 8.6 p -155.68 84.25 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.138 -0.976 . . . . 0.0 111.28 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.514 ' H ' ' HB1' ' A' ' 11' ' ' ALA . 0.5 OUTLIER 48.7 101.91 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.367 -0.833 . . . . 0.0 112.406 178.812 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 138.0 -22.03 3.13 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 119.392 -1.385 . . . . 0.0 112.219 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p -125.62 139.41 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 CA-C-N 119.737 1.769 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -80.18 141.6 35.51 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.202 -0.936 . . . . 0.0 109.81 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.438 ' HD3' HD13 ' A' ' 25' ' ' ILE . 2.8 ptt85 -129.5 143.74 50.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.225 -0.922 . . . . 0.0 110.276 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 1.079 HG23 HG12 ' A' ' 8' ' ' VAL . 12.3 mt -111.11 126.48 68.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.186 -0.946 . . . . 0.0 109.181 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.9 154.15 16.72 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.491 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 11.3 pttp -127.8 143.43 51.13 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.129 -1.218 . . . . 0.0 109.589 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.3 t -108.53 109.66 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.012 -1.055 . . . . 0.0 109.949 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.9 t -115.39 113.22 43.29 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.186 -0.947 . . . . 0.0 109.829 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.17 150.09 53.01 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 O-C-N 123.196 1.103 . . . . 0.0 110.427 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -102.37 163.31 17.92 Favored Pre-proline 0 N--CA 1.499 2.024 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.81 148.78 52.9 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.412 1.217 . . . . 0.0 110.339 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 54.31 97.83 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.024 -1.048 . . . . 0.0 110.711 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -133.28 123.76 26.08 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.128 -0.983 . . . . 0.0 110.015 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -102.78 -47.64 4.34 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.128 -0.982 . . . . 0.0 110.653 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.6 t -88.2 -44.11 11.11 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.099 -1.001 . . . . 0.0 110.407 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -148.34 -102.18 0.28 Allowed Glycine 0 N--CA 1.496 2.68 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 110.51 55.35 0.52 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -146.25 130.06 17.15 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.191 -1.182 . . . . 0.0 110.173 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.6 mtt -117.96 128.22 54.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.133 -0.979 . . . . 0.0 110.588 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -126.83 123.08 36.52 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.171 -0.956 . . . . 0.0 109.792 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -118.27 142.6 47.32 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.134 -0.978 . . . . 0.0 110.411 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -99.25 114.1 26.74 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.173 -0.954 . . . . 0.0 110.611 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.519 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.3 OUTLIER -124.79 174.15 8.11 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.018 -1.051 . . . . 0.0 109.811 177.495 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.499 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 64.4 m80 -92.92 -173.7 3.37 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.454 -0.779 . . . . 0.0 110.664 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.611 HG22 ' CE1' ' A' ' 93' ' ' HIS . 37.9 mm -82.93 -56.63 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -58.56 -38.74 78.49 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.18 -0.95 . . . . 0.0 109.49 178.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.9 m -60.33 -51.31 70.07 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.272 -0.893 . . . . 0.0 109.104 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.467 ' HG2' HD11 ' A' ' 70' ' ' ILE . 10.5 tpt -68.8 -45.42 71.31 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.446 -0.784 . . . . 0.0 109.374 179.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 93' ' ' HIS . 9.5 m-85 -63.07 -30.24 71.44 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.244 -0.983 . . . . 0.0 109.949 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -65.7 -42.13 91.53 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.847 -1.158 . . . . 0.0 109.034 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -65.58 -41.04 93.33 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.277 -0.889 . . . . 0.0 108.979 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 56' ' ' MET . 7.5 mp -55.34 -41.02 71.94 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.139 -0.976 . . . . 0.0 109.152 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.11 -33.91 65.55 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.287 -0.883 . . . . 0.0 109.562 178.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -104.57 30.82 5.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.147 -0.97 . . . . 0.0 110.396 179.097 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -111.1 169.57 8.69 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.969 -1.082 . . . . 0.0 110.109 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.15 156.55 19.19 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.146 -0.971 . . . . 0.0 110.25 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.37 -33.59 65.14 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.26 -0.9 . . . . 0.0 110.748 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.42 -36.56 33.63 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 120.978 -1.076 . . . . 0.0 110.892 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.6 m -112.58 117.11 31.41 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.209 -0.932 . . . . 0.0 110.082 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.6 tttt -116.49 144.46 44.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.194 -0.941 . . . . 0.0 110.28 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.34 155.53 41.88 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.196 -0.94 . . . . 0.0 110.287 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.908 HG23 HD11 ' A' ' 76' ' ' LEU . 80.0 mt 54.14 99.11 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.178 -0.951 . . . . 0.0 110.797 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.9 132.35 54.28 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.0 109.729 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.94 -164.17 0.07 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.023 -1.048 . . . . 0.0 110.777 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.728 HD23 ' HE2' ' A' ' 87' ' ' LYS . 46.0 tp -114.02 -55.42 2.5 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.97 -36.99 60.82 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.014 -1.054 . . . . 0.0 110.724 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -50.62 -31.07 14.99 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.057 -1.027 . . . . 0.0 111.302 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.908 HD11 HG23 ' A' ' 70' ' ' ILE . 89.0 mt -87.35 152.19 22.48 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.889 -1.132 . . . . 0.0 110.305 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -96.31 137.13 35.84 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.243 -0.911 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.56 -49.44 0.85 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.447 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 55.6 p-90 -50.81 -32.0 18.75 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.116 -1.226 . . . . 0.0 111.151 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 3.8 tm-20 -53.52 -28.04 29.09 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.94 -1.1 . . . . 0.0 111.416 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -110.05 24.22 13.3 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.878 -1.139 . . . . 0.0 112.244 -179.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.772 HD13 ' CD2' ' A' ' 10' ' ' TYR . 21.6 mt -111.1 -164.8 0.94 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.723 -1.235 . . . . 0.0 109.678 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -88.02 161.85 17.14 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.926 -1.109 . . . . 0.0 110.312 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.13 -49.26 17.81 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.923 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -61.92 -42.7 99.39 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.305 -0.872 . . . . 0.0 109.366 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 21.3 mt-10 -62.58 -40.62 97.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.728 ' HE2' HD23 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -59.3 -39.81 84.19 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.208 -0.932 . . . . 0.0 109.932 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -58.36 -39.69 80.23 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.247 -0.908 . . . . 0.0 110.062 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -59.47 -35.82 74.82 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.6 HG22 HD13 ' A' ' 73' ' ' LEU . 47.9 mm -70.46 -38.39 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.1 -1.0 . . . . 0.0 109.434 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -38.86 92.82 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.031 -1.043 . . . . 0.0 109.391 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -57.23 -35.8 70.13 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.163 -0.961 . . . . 0.0 110.016 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.611 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.7 m-70 -55.57 -50.01 71.21 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.05 -1.031 . . . . 0.0 109.941 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.74 -38.24 81.81 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.314 -0.954 . . . . 0.0 109.15 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.8 -39.63 83.97 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.575 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.43 -39.92 94.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.19 -0.944 . . . . 0.0 109.414 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -82.52 -34.77 27.79 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.9 m -103.69 60.56 0.75 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.133 -0.979 . . . . 0.0 109.983 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.0 t -109.08 81.38 1.43 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.053 -1.03 . . . . 0.0 110.25 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -131.96 116.71 17.48 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.167 -0.958 . . . . 0.0 110.087 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 53.01 81.28 0.09 Allowed 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.095 -1.003 . . . . 0.0 110.701 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.42 -58.51 2.08 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.191 -0.943 . . . . 0.0 110.201 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 120.61 59.64 0.24 Allowed Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.5 p -140.17 95.33 8.42 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.264 -1.139 . . . . 0.0 110.154 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.43 162.81 40.43 Favored 'Trans proline' 0 C--N 1.317 -1.104 0 O-C-N 123.408 1.215 . . . . 0.0 110.398 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -140.91 106.76 5.14 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.234 -0.916 . . . . 0.0 110.199 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -122.7 81.39 1.85 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.202 -0.936 . . . . 0.0 110.236 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.4 mtpt -141.67 -175.17 4.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.251 -0.906 . . . . 0.0 110.149 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.51 114.17 20.85 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.237 -0.915 . . . . 0.0 110.291 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.64 126.11 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.156 -0.965 . . . . 0.0 109.985 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.4 p -137.76 144.66 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.225 -0.922 . . . . 0.0 110.193 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -119.53 89.23 3.09 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.037 -1.039 . . . . 0.0 110.171 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -132.62 127.52 35.14 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.133 -0.979 . . . . 0.0 110.327 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.6 ttpt -124.53 131.56 53.48 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.17 -0.956 . . . . 0.0 110.268 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.1 mt -123.31 139.88 53.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.202 -0.936 . . . . 0.0 110.242 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -124.02 149.44 46.05 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.231 -0.918 . . . . 0.0 110.194 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.228 179.998 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.501 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 21.2 mtp . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 64.34 -71.4 0.07 Allowed 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.218 -0.926 . . . . 0.0 110.838 179.974 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -140.76 42.72 1.84 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.988 -1.07 . . . . 0.0 110.221 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -147.44 133.33 19.09 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.257 -0.902 . . . . 0.0 110.456 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 -133.69 138.73 46.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.141 -0.974 . . . . 0.0 110.344 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.603 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -131.55 141.04 49.61 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.291 -0.881 . . . . 0.0 109.675 179.986 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.438 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.8 m -152.69 166.72 31.26 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.33 -0.856 . . . . 0.0 109.956 179.199 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.712 HG22 ' HB2' ' A' ' 77' ' ' GLU . 6.1 m -104.64 141.4 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 120.864 -1.148 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.436 ' CB ' ' CZ3' ' A' ' 50' ' ' TRP . 10.1 t0 -136.91 147.92 46.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.298 -0.877 . . . . 0.0 109.261 179.224 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.64 ' CD2' HD13 ' A' ' 82' ' ' LEU . 59.9 m-85 -102.48 154.29 19.23 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.22 -0.925 . . . . 0.0 110.311 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.08 133.9 34.21 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.26 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -134.15 106.06 6.98 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 52.97 95.07 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.041 -1.037 . . . . 0.0 110.806 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.6 144.38 4.81 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.709 -1.356 . . . . 0.0 109.709 179.904 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 p -117.77 134.49 54.86 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.219 -1.165 . . . . 0.0 110.125 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.83 134.35 49.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.189 -0.944 . . . . 0.0 110.721 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.82 124.62 31.18 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . 22.4 t -62.41 128.53 36.47 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.355 -1.086 . . . . 0.0 109.337 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 145.94 47.97 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.5 mttt 52.58 48.74 21.89 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.901 -1.124 . . . . 0.0 109.732 -179.231 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.69 151.42 9.2 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.351 -0.843 . . . . 0.0 110.656 -178.328 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -101.93 49.76 0.85 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.138 -0.976 . . . . 0.0 108.57 178.525 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.6 -174.1 4.23 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.474 -0.766 . . . . 0.0 110.18 -178.833 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -133.31 159.66 39.61 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.118 -0.989 . . . . 0.0 109.914 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.407 HG21 ' HD2' ' A' ' 31' ' ' ARG . 62.9 mt -104.51 105.02 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.409 -0.807 . . . . 0.0 109.526 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.732 ' O ' HG12 ' A' ' 29' ' ' VAL . 12.8 p -104.65 161.66 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.188 -0.945 . . . . 0.0 110.583 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -46.13 138.57 5.17 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.466 -0.771 . . . . 0.0 111.195 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.02 0.77 51.64 Favored Glycine 0 N--CA 1.493 2.466 0 C-N-CA 120.163 -1.018 . . . . 0.0 111.036 -179.202 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.732 HG12 ' O ' ' A' ' 26' ' ' VAL . 10.4 p -125.62 135.58 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-N 119.549 1.674 . . . . 0.0 109.86 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.651 ' HB3' HD11 ' A' ' 53' ' ' ILE . 21.0 t -89.44 138.84 31.09 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 -179.609 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.407 ' HD2' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -127.45 154.1 45.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.334 -0.854 . . . . 0.0 110.138 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.468 HD12 ' CG ' ' A' ' 56' ' ' MET . 20.8 mt -102.07 136.53 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.18 -0.95 . . . . 0.0 110.185 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.439 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.1 126.0 8.51 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.574 -1.81 . . . . 0.0 108.574 179.183 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 74.8 tttt -105.13 114.62 28.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.177 -1.19 . . . . 0.0 109.742 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -96.04 121.2 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.212 -0.93 . . . . 0.0 110.429 -179.795 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.7 t -119.86 110.75 36.39 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.215 -0.928 . . . . 0.0 109.417 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.03 147.61 43.49 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.24 1.126 . . . . 0.0 110.638 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -103.2 164.83 14.7 Favored Pre-proline 0 N--CA 1.499 2.014 0 O-C-N 121.268 -0.895 . . . . 0.0 110.006 179.705 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.65 178.19 5.39 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.392 1.207 . . . . 0.0 110.29 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 56.9 t80 62.96 -69.12 0.07 Allowed 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.509 -0.744 . . . . 0.0 111.333 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 t -114.79 122.42 46.32 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.668 -1.27 . . . . 0.0 110.175 179.857 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -101.79 -47.71 4.52 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.194 -0.941 . . . . 0.0 110.303 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.8 t -57.09 -40.4 76.91 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.072 -1.017 . . . . 0.0 110.248 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -114.08 40.76 2.38 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.2 71.0 0.33 Allowed Glycine 0 N--CA 1.495 2.586 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -143.56 142.47 31.11 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.175 -1.191 . . . . 0.0 110.299 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.6 mtt -116.39 140.59 49.18 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.21 -0.931 . . . . 0.0 110.148 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -129.75 122.64 29.27 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.133 -0.979 . . . . 0.0 110.54 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -116.65 145.45 43.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.142 -0.974 . . . . 0.0 109.694 179.62 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.439 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 16.6 m95 -97.37 139.82 32.75 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.108 -0.995 . . . . 0.0 110.084 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -125.43 173.19 9.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 110.064 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 1.7 m80 -90.91 -172.67 3.43 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.526 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.975 HG22 ' CE1' ' A' ' 93' ' ' HIS . 44.5 mm -84.79 -40.29 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 120.962 -1.086 . . . . 0.0 109.161 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -86.45 -31.11 21.55 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.997 -1.064 . . . . 0.0 110.634 178.905 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 78.9 m -66.56 -51.01 61.17 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.951 -1.093 . . . . 0.0 109.923 179.807 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.468 ' CG ' HD12 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -66.22 -40.21 90.14 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.007 -179.716 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.488 ' CD2' ' CD2' ' A' ' 93' ' ' HIS . 5.8 m-85 -70.44 -32.62 70.28 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 118.938 -1.105 . . . . 0.0 109.553 178.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.96 -36.97 78.25 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.97 -1.081 . . . . 0.0 109.592 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -59.29 -40.18 85.33 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.122 -0.986 . . . . 0.0 109.787 179.469 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -57.72 -42.66 84.28 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.194 -0.942 . . . . 0.0 109.327 179.286 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.95 -34.04 71.31 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.625 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -107.55 31.01 5.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.19 -0.944 . . . . 0.0 110.639 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.48 166.99 10.55 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.995 -1.066 . . . . 0.0 110.136 179.854 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.9 ttt180 -64.5 155.31 33.26 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.229 -0.919 . . . . 0.0 110.05 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.54 -34.6 19.91 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.167 -0.958 . . . . 0.0 110.662 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.2 p -51.66 -36.57 46.85 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.896 -1.127 . . . . 0.0 110.829 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.1 m -111.61 131.54 55.2 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.153 -0.967 . . . . 0.0 110.171 179.845 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -117.05 144.04 45.08 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.212 -0.93 . . . . 0.0 110.347 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.8 mttt -119.19 133.8 55.56 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.261 -0.899 . . . . 0.0 110.227 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.778 ' HA ' HD21 ' A' ' 76' ' ' LEU . 74.5 mt 54.36 98.74 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.14 -0.975 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -112.82 137.55 50.99 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.086 -1.009 . . . . 0.0 109.996 179.585 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.42 -164.04 0.09 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.998 -1.063 . . . . 0.0 110.704 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.64 HD22 ' OG1' ' A' ' 91' ' ' THR . 56.6 tp -112.87 160.32 18.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.104 -0.997 . . . . 0.0 110.137 -179.778 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.445 HG23 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER 60.36 46.24 10.23 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.037 -1.039 . . . . 0.0 110.178 -179.829 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.767 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.8 mm-40 -112.91 -62.27 1.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.142 -0.974 . . . . 0.0 109.537 179.348 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.778 HD21 ' HA ' ' A' ' 70' ' ' ILE . 0.9 OUTLIER -138.3 65.62 1.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.266 -0.896 . . . . 0.0 109.491 178.732 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.712 ' HB2' HG22 ' A' ' 8' ' ' VAL . 10.2 pt-20 -143.01 141.87 31.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.858 -1.151 . . . . 0.0 110.956 179.492 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.76 68.54 1.89 Allowed Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.186 -1.566 . . . . 0.0 109.186 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.445 ' CE2' HG23 ' A' ' 74' ' ' THR . 58.6 p-90 -91.81 -32.87 15.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.147 -1.208 . . . . 0.0 111.207 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -52.54 -29.42 25.34 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.838 -1.164 . . . . 0.0 111.17 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -94.86 -38.73 10.6 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.852 -1.155 . . . . 0.0 110.618 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.64 HD13 ' CD2' ' A' ' 10' ' ' TYR . 92.5 mt -70.67 -175.69 1.13 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.949 -1.095 . . . . 0.0 110.015 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -63.91 150.13 45.67 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.225 -0.922 . . . . 0.0 110.16 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -88.45 -39.95 13.85 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.246 -0.909 . . . . 0.0 110.32 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -58.03 -40.82 81.83 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 121.245 -0.909 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.431 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.4 mt-10 -59.78 -39.56 85.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.285 -0.884 . . . . 0.0 109.764 179.624 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.447 ' HG2' HD21 ' A' ' 73' ' ' LEU . 3.8 ttpm? -58.69 -38.52 78.41 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.185 -0.947 . . . . 0.0 110.09 179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -59.06 -45.69 90.15 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.733 179.738 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -59.17 -34.24 71.87 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.224 -0.922 . . . . 0.0 110.164 179.299 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.5 mm -58.9 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.056 -1.028 . . . . 0.0 109.439 179.419 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.64 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -57.69 -41.38 81.53 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.095 -1.003 . . . . 0.0 109.649 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -62.56 -41.55 98.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.214 179.207 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.975 ' CE1' HG22 ' A' ' 53' ' ' ILE . 72.9 t60 -60.65 -46.47 90.18 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.266 -0.896 . . . . 0.0 109.567 179.541 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.457 HG12 ' CE1' ' A' ' 57' ' ' PHE . 25.7 mt -62.41 -39.5 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.181 -0.95 . . . . 0.0 109.396 179.422 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.403 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -60.47 -39.97 89.57 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.202 -0.936 . . . . 0.0 109.717 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -61.44 -44.22 97.5 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.261 -0.9 . . . . 0.0 109.345 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.469 HD22 ' HD1' ' A' ' 57' ' ' PHE . 5.0 tp -60.23 -35.1 74.68 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.353 -0.842 . . . . 0.0 110.035 179.385 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.0 t -100.59 67.29 1.28 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.053 -1.029 . . . . 0.0 110.077 179.822 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 8.4 m -137.67 162.66 33.24 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.115 -0.991 . . . . 0.0 110.184 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -124.62 41.4 3.51 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.207 -0.933 . . . . 0.0 110.187 -179.968 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.06 81.99 1.82 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.222 -0.924 . . . . 0.0 110.165 179.963 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.99 -175.37 3.34 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.19 -0.943 . . . . 0.0 110.267 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -108.3 -153.9 17.15 Favored Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 28.4 p -142.16 97.25 6.34 Favored Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.15 -1.206 . . . . 0.0 110.268 -179.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.45 151.42 53.44 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.355 1.187 . . . . 0.0 110.433 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.4 tptp -117.65 102.95 9.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.192 -0.943 . . . . 0.0 110.214 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 7.8 mttm -139.86 130.37 25.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.228 -0.92 . . . . 0.0 110.21 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -119.65 50.37 1.27 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.19 -0.944 . . . . 0.0 110.2 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.07 156.71 27.09 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.215 -0.928 . . . . 0.0 110.22 179.935 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.2 t -116.52 136.57 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.168 -0.958 . . . . 0.0 109.919 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 61.0 t -121.0 118.34 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.177 -0.952 . . . . 0.0 109.911 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -121.0 106.61 11.76 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.219 -0.925 . . . . 0.0 110.184 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.22 141.18 51.11 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.259 -0.901 . . . . 0.0 110.215 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -116.78 137.04 52.48 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.183 -0.948 . . . . 0.0 110.21 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 82.2 mt -123.93 106.72 10.65 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.246 -0.908 . . . . 0.0 110.201 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.5 m -137.8 98.52 3.68 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.211 -0.93 . . . . 0.0 110.201 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.182 -179.994 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttt . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -127.14 68.59 1.28 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.241 -0.912 . . . . 0.0 110.2 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -118.17 -57.29 2.1 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.264 -179.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -114.64 149.34 36.82 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.125 -0.984 . . . . 0.0 110.2 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -125.24 153.79 42.63 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.222 -0.924 . . . . 0.0 110.393 -179.92 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.525 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.6 OUTLIER -146.13 134.85 22.28 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.344 -0.848 . . . . 0.0 109.866 -179.943 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 p -152.73 165.49 35.13 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.052 -1.03 . . . . 0.0 109.871 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.614 HG22 ' HB2' ' A' ' 77' ' ' GLU . 11.1 m -101.81 116.23 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 120.91 -1.119 . . . . 0.0 110.606 179.618 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -105.0 141.78 35.97 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.019 -1.051 . . . . 0.0 109.239 179.057 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 83' ' ' GLU . 73.2 m-85 -100.35 152.14 20.67 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.156 -0.965 . . . . 0.0 110.192 -179.793 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -100.68 135.54 41.96 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.363 -0.836 . . . . 0.0 110.025 179.664 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 mtpt -114.18 -55.1 2.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.146 -0.971 . . . . 0.0 110.348 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -133.8 156.13 48.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.185 -0.947 . . . . 0.0 110.256 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 162.61 24.13 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.803 HG23 ' O ' ' A' ' 25' ' ' ILE . 89.4 m -138.31 145.42 41.2 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.226 -1.161 . . . . 0.0 110.192 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -140.92 141.85 34.49 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.218 -0.926 . . . . 0.0 110.736 -179.835 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.41 127.58 44.14 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.33 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.469 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 31.3 p -65.74 121.65 15.48 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.148 -1.207 . . . . 0.0 110.931 -178.425 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 29.7 mmtt -66.89 156.32 36.08 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.335 -0.853 . . . . 0.0 108.972 179.717 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.84 16.35 10.41 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.84 -1.163 . . . . 0.0 111.92 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.4 p -175.24 149.33 1.05 Allowed 'General case' 0 N--CA 1.504 2.256 0 O-C-N 120.571 -1.33 . . . . 0.0 110.726 178.095 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -86.64 88.36 7.65 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.021 -1.049 . . . . 0.0 111.678 -178.021 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.406 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.1 tt0 -165.27 -173.73 2.96 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 179.01 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -130.81 153.8 48.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.019 -1.051 . . . . 0.0 109.833 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.803 ' O ' HG23 ' A' ' 15' ' ' THR . 87.4 mt -107.73 122.5 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.277 -0.889 . . . . 0.0 109.969 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.474 HG22 ' HG2' ' A' ' 27' ' ' LYS . 12.2 p -120.09 160.3 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.243 -0.911 . . . . 0.0 110.323 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HG22 ' A' ' 26' ' ' VAL . 3.7 pttt -47.83 132.04 14.84 Favored 'General case' 0 N--CA 1.515 2.821 0 O-C-N 121.386 -0.821 . . . . 0.0 111.28 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.4 8.59 40.53 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.117 -1.039 . . . . 0.0 111.727 -179.915 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.472 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.7 p -124.97 137.01 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-N 119.723 1.762 . . . . 0.0 110.612 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.1 t -94.43 133.46 38.01 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.161 -0.962 . . . . 0.0 109.942 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.24 148.61 50.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.266 -0.896 . . . . 0.0 110.151 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.42 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 10.1 mt -104.36 123.89 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.083 -1.01 . . . . 0.0 109.425 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.446 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -106.02 143.93 15.77 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 179.569 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.463 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 27.4 tttt -108.37 117.17 33.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -1.136 . . . . 0.0 108.774 179.679 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -96.4 108.7 21.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.01 -1.056 . . . . 0.0 110.467 -179.421 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 37' ' ' PRO . 9.0 p -123.62 143.43 41.7 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.301 -0.874 . . . . 0.0 110.041 179.354 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 36' ' ' VAL . 49.8 Cg_endo -76.22 143.77 25.69 Favored 'Trans proline' 0 C--N 1.317 -1.084 0 O-C-N 123.101 1.053 . . . . 0.0 110.342 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -103.58 121.48 48.18 Favored Pre-proline 0 N--CA 1.5 2.033 0 O-C-N 121.189 -0.944 . . . . 0.0 110.088 179.783 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -72.2 79.37 1.75 Allowed 'Trans proline' 0 C--N 1.319 -0.996 0 O-C-N 123.127 1.067 . . . . 0.0 110.245 179.785 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -145.51 -58.56 0.33 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.222 -0.924 . . . . 0.0 110.458 -179.721 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.48 157.99 15.65 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.124 -0.985 . . . . 0.0 110.112 179.728 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -94.38 -35.36 12.4 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.232 -0.917 . . . . 0.0 110.768 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.55 -37.73 65.77 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 120.91 -1.119 . . . . 0.0 110.556 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 142.22 -176.66 22.04 Favored Glycine 0 N--CA 1.495 2.588 0 N-CA-C 109.661 -1.375 . . . . 0.0 109.661 179.857 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.23 137.27 3.27 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -132.77 151.42 52.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.205 -1.173 . . . . 0.0 110.038 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.6 ttp -113.6 130.99 56.28 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.226 -0.921 . . . . 0.0 110.53 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -139.15 136.77 35.46 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.948 . . . . 0.0 110.084 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -122.1 153.48 38.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.174 -0.954 . . . . 0.0 109.399 179.856 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 16.1 m95 -107.5 114.1 27.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.109 -0.994 . . . . 0.0 111.033 -179.872 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -123.35 171.32 9.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.193 -0.942 . . . . 0.0 109.224 177.412 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.469 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 58.9 m80 -86.72 -175.19 5.32 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.269 -179.78 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.513 HG22 ' ND1' ' A' ' 93' ' ' HIS . 31.9 mm -85.33 -47.06 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 178.211 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -64.85 -40.01 94.46 Favored 'General case' 0 N--CA 1.504 2.234 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.056 178.126 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 51.1 m -62.09 -45.99 91.04 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.084 179.071 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.418 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -70.19 -46.65 64.15 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.414 -0.804 . . . . 0.0 109.661 179.86 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -67.13 -28.96 68.58 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.975 179.368 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -76.83 -42.74 39.15 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.777 -1.202 . . . . 0.0 108.899 178.545 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.2 tptp -66.77 -39.76 87.98 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.42 -0.912 . . . . 0.0 108.796 178.415 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.587 HD21 ' CB ' ' A' ' 69' ' ' LYS . 6.0 tp -55.74 -41.22 73.61 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.256 -0.902 . . . . 0.0 109.21 178.79 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -59.75 -34.86 73.5 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.288 -0.883 . . . . 0.0 109.555 178.542 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 -108.77 32.65 4.72 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.145 -0.972 . . . . 0.0 110.538 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.726 ' HB1' HG21 ' A' ' 67' ' ' THR . . . -92.67 168.87 10.93 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.954 -1.092 . . . . 0.0 110.305 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 mtt85 -62.76 157.57 20.8 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.262 -0.899 . . . . 0.0 110.415 -179.644 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.85 -33.4 68.62 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.22 -0.925 . . . . 0.0 110.79 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.0 p -92.97 57.69 2.82 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 120.895 -1.128 . . . . 0.0 110.013 179.811 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.726 HG21 ' HB1' ' A' ' 63' ' ' ALA . 6.7 p -117.31 163.12 16.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.259 -0.901 . . . . 0.0 110.072 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.494 ' O ' HD11 ' A' ' 60' ' ' LEU . 7.0 ttpt -95.35 130.63 42.06 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.2 -0.937 . . . . 0.0 109.673 179.527 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.587 ' CB ' HD21 ' A' ' 60' ' ' LEU . 18.1 mtmt -113.02 159.25 19.34 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.209 -0.932 . . . . 0.0 110.563 -179.405 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.2 mt -111.37 120.2 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.696 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -114.05 152.78 30.5 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.273 -0.892 . . . . 0.0 109.724 179.583 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 52.86 -165.23 0.07 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.027 -1.046 . . . . 0.0 110.487 -179.753 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 1.044 HD11 HG22 ' A' ' 90' ' ' ILE . 1.6 tp -138.02 -164.78 1.68 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.147 -0.971 . . . . 0.0 110.162 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.58 HG22 ' CE2' ' A' ' 79' ' ' TRP . 4.5 p 46.84 43.3 13.13 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.169 -0.957 . . . . 0.0 111.204 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.777 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.1 tp10 -113.43 -55.84 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.251 -0.905 . . . . 0.0 110.055 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.777 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.3 pt? -146.59 63.42 1.2 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.082 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.614 ' HB2' HG22 ' A' ' 8' ' ' VAL . 5.2 pt-20 -144.46 141.28 29.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.063 -1.023 . . . . 0.0 110.699 178.888 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.08 66.2 3.46 Favored Glycine 0 N--CA 1.496 2.672 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.439 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.58 ' CE2' HG22 ' A' ' 74' ' ' THR . 51.1 p-90 -90.91 -39.22 12.41 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.073 -1.251 . . . . 0.0 110.512 179.865 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.86 -24.13 67.44 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.227 -0.921 . . . . 0.0 111.072 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -95.96 -29.63 14.06 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.714 -1.241 . . . . 0.0 111.497 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.1 mt -94.77 -79.79 0.42 Allowed 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.8 -1.187 . . . . 0.0 110.773 -179.741 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 5.8 mt-10 -125.39 132.62 52.74 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.7 -1.25 . . . . 0.0 110.829 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -89.07 -43.94 10.72 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.13 -0.981 . . . . 0.0 109.554 178.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -62.02 -40.99 97.56 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.365 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -56.08 -38.99 71.43 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.219 -0.925 . . . . 0.0 109.683 179.058 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.852 ' HA ' HD12 ' A' ' 90' ' ' ILE . 1.3 ttpt -55.53 -38.17 68.9 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.08 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.4 -44.17 97.61 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 109.607 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -64.11 -39.07 93.25 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.261 -0.899 . . . . 0.0 109.883 179.633 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 1.044 HG22 HD11 ' A' ' 73' ' ' LEU . 12.6 mt -61.41 -35.1 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.219 -0.925 . . . . 0.0 109.546 179.367 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.451 ' OG1' HD22 ' A' ' 73' ' ' LEU . 3.7 m -60.77 -38.95 86.99 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.812 -1.18 . . . . 0.0 109.576 179.134 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -57.13 -38.53 73.6 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.266 -0.896 . . . . 0.0 109.901 179.395 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.513 ' ND1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -53.05 -43.47 66.68 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.06 -1.025 . . . . 0.0 110.178 179.753 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.461 HD13 HD13 ' A' ' 73' ' ' LEU . 1.5 mp -65.97 -40.55 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.323 -0.951 . . . . 0.0 108.873 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.49 -36.95 81.93 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.969 179.312 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -70.63 -37.75 73.83 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.2 tp -79.73 -31.94 41.12 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.046 -1.034 . . . . 0.0 110.736 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.3 m -92.04 -39.48 11.62 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.192 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.9 m -115.65 114.0 24.29 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.081 -1.012 . . . . 0.0 110.1 179.885 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -117.66 -57.57 2.11 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.179 -0.95 . . . . 0.0 110.284 -179.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -116.92 -61.08 1.77 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.189 -0.944 . . . . 0.0 110.188 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.91 43.48 3.12 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.247 -0.908 . . . . 0.0 110.156 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -94.06 91.95 1.51 Allowed Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 29.9 p -120.46 66.95 13.02 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.21 -1.171 . . . . 0.0 110.175 179.939 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.9 -43.15 0.86 Allowed 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.284 1.15 . . . . 0.0 110.454 -179.875 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.5 mttt -118.26 137.26 53.17 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.196 -0.94 . . . . 0.0 110.284 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.2 ttmm -116.83 -56.53 2.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.167 -0.958 . . . . 0.0 110.239 -179.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -129.14 52.87 1.92 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.126 -0.984 . . . . 0.0 110.227 179.955 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.95 104.94 11.79 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.222 -0.924 . . . . 0.0 110.229 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.9 t -129.88 148.08 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.212 -0.93 . . . . 0.0 109.994 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.5 p -136.1 143.24 36.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.245 -0.909 . . . . 0.0 110.167 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -131.01 128.19 39.86 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.166 -0.959 . . . . 0.0 110.266 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -129.38 107.14 9.28 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.214 -0.929 . . . . 0.0 110.251 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -121.05 112.31 18.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.171 -0.955 . . . . 0.0 110.252 179.991 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.2 mt -125.43 132.96 52.63 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.236 -0.915 . . . . 0.0 110.228 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 36.6 p -130.7 115.84 17.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.191 -0.943 . . . . 0.0 110.212 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.8 m . . . . . 0 N--CA 1.494 1.751 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.144 -179.962 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 120.725 0.298 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.12 135.2 53.35 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.099 -1.001 . . . . 0.0 110.195 -179.945 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -123.32 72.07 1.1 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.187 -0.946 . . . . 0.0 110.237 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -122.46 139.59 53.7 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.159 -0.963 . . . . 0.0 110.117 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -141.97 135.18 29.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.178 -0.951 . . . . 0.0 110.228 -179.913 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.777 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.1 m-85 -118.37 137.55 53.04 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.212 -0.93 . . . . 0.0 110.127 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.419 ' O ' HG23 ' A' ' 32' ' ' ILE . 11.7 m -122.78 159.47 27.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.186 -0.946 . . . . 0.0 109.295 179.511 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.521 HG12 HG23 ' A' ' 32' ' ' ILE . 25.8 m -130.08 116.17 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.038 -1.038 . . . . 0.0 110.311 179.577 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.16 151.82 37.66 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.999 -1.063 . . . . 0.0 110.298 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.676 ' HB2' HD22 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -104.97 144.77 31.35 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.309 -0.87 . . . . 0.0 109.602 179.739 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.03 113.35 25.02 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.168 -0.957 . . . . 0.0 110.386 -179.762 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -113.48 -56.06 2.45 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.236 -0.915 . . . . 0.0 109.886 179.733 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.2 ttm-85 -125.52 39.02 4.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.178 -0.951 . . . . 0.0 110.133 179.768 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.12 155.06 25.94 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 t -146.59 146.03 30.3 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.286 -1.126 . . . . 0.0 110.279 179.984 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -156.08 149.01 24.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.193 -0.942 . . . . 0.0 111.589 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.96 125.88 41.02 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.09 140.9 56.57 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.309 -1.112 . . . . 0.0 110.361 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HB2' ' HB3' ' A' ' 49' ' ' GLU . 0.5 OUTLIER -88.99 153.8 20.72 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.944 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.36 33.01 22.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.84 -1.163 . . . . 0.0 109.664 -178.761 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 132.0 0.09 Allowed 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.772 -1.205 . . . . 0.0 109.372 -179.768 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.36 72.61 4.9 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.07 -1.019 . . . . 0.0 109.91 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -151.33 -175.52 5.21 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.247 -0.908 . . . . 0.0 110.318 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -133.38 156.83 46.95 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.914 -1.116 . . . . 0.0 109.756 -179.27 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.604 HD11 ' O ' ' A' ' 50' ' ' TRP . 56.4 mt -105.03 114.95 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.344 -0.847 . . . . 0.0 109.617 179.929 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.623 ' O ' HG12 ' A' ' 29' ' ' VAL . 58.9 t -110.61 160.93 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.21 -0.931 . . . . 0.0 110.3 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -47.11 144.75 2.48 Favored 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.406 -0.809 . . . . 0.0 111.125 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 90.17 9.67 65.17 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.072 -1.061 . . . . 0.0 111.068 -179.35 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.5 p -125.1 133.95 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 119.485 1.642 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 25.4 p -89.99 139.04 30.99 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.167 -0.958 . . . . 0.0 110.0 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.09 150.67 52.04 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.238 -0.913 . . . . 0.0 110.616 -179.68 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.521 HG23 HG12 ' A' ' 8' ' ' VAL . 20.5 mt -113.32 134.46 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.288 -0.883 . . . . 0.0 109.537 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.78 127.92 9.16 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.473 ' CB ' ' OH ' ' A' ' 51' ' ' TYR . 17.5 tttp -103.15 118.36 36.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.128 -1.219 . . . . 0.0 109.585 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.462 HG22 ' HB2' ' A' ' 48' ' ' LYS . 47.2 t -94.31 119.2 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.175 -0.953 . . . . 0.0 110.189 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.444 HG22 ' HE3' ' A' ' 34' ' ' LYS . 63.0 t -116.44 111.94 41.67 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.201 -0.937 . . . . 0.0 109.698 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.04 140.96 32.15 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 O-C-N 123.123 1.065 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -103.69 150.89 38.6 Favored Pre-proline 0 N--CA 1.498 1.944 0 O-C-N 121.178 -0.951 . . . . 0.0 110.138 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.92 70.95 3.52 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.389 1.204 . . . . 0.0 110.277 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -147.07 -58.94 0.28 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.161 -0.962 . . . . 0.0 110.418 -179.935 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.3 t -113.96 156.04 24.75 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.123 -0.986 . . . . 0.0 110.247 179.974 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -102.36 -49.35 3.9 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.24 -0.913 . . . . 0.0 110.182 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.9 t -60.39 -40.43 90.85 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.205 -0.934 . . . . 0.0 110.049 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -133.46 -155.17 7.63 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.31 68.94 1.06 Allowed Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -143.13 143.64 31.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.168 -1.195 . . . . 0.0 110.227 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.1 ttp -114.85 124.15 51.0 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.208 -0.932 . . . . 0.0 110.25 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.462 ' HB2' HG22 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -138.08 123.09 19.06 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.198 -0.939 . . . . 0.0 110.178 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 19' ' ' LYS . 23.5 mt-10 -120.63 156.41 31.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.092 -1.005 . . . . 0.0 109.818 179.517 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.604 ' O ' HD11 ' A' ' 25' ' ' ILE . 64.8 m95 -100.53 118.63 37.1 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.086 -1.009 . . . . 0.0 110.562 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.473 ' OH ' ' CB ' ' A' ' 34' ' ' LYS . 0.2 OUTLIER -132.58 163.26 29.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.182 -0.949 . . . . 0.0 110.282 178.301 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -58.5 -172.29 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.421 -0.8 . . . . 0.0 109.749 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.511 HG22 ' ND1' ' A' ' 93' ' ' HIS . 41.3 mm -88.12 -50.8 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.097 -1.002 . . . . 0.0 109.118 179.448 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.6 tttp -56.37 -28.33 58.85 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.347 -0.846 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.9 m -65.07 -39.08 92.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 120.856 -1.152 . . . . 0.0 110.251 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.2 tpt -80.31 -40.64 26.4 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.144 -0.973 . . . . 0.0 109.195 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -70.47 -29.29 65.81 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.369 -0.933 . . . . 0.0 109.901 178.526 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -65.96 -38.1 87.71 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.918 -1.114 . . . . 0.0 109.458 179.209 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -58.08 -37.79 75.15 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.116 -0.99 . . . . 0.0 109.938 179.535 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.453 ' N ' HD12 ' A' ' 60' ' ' LEU . 11.0 mp -69.34 -41.56 76.47 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 109.519 179.484 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.756 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.8 mm-40 -68.29 -34.56 76.39 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.267 -0.896 . . . . 0.0 110.234 179.465 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -37.09 33.81 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.065 -1.022 . . . . 0.0 110.284 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -128.3 142.63 51.08 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.013 -1.054 . . . . 0.0 110.093 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.71 101.56 9.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.164 -0.96 . . . . 0.0 110.216 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.428 ' O ' HG23 ' A' ' 67' ' ' THR . . . -89.95 3.46 53.04 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.222 -0.924 . . . . 0.0 112.011 179.497 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 55.56 36.76 27.82 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.381 -1.449 . . . . 0.0 110.45 -179.299 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 65' ' ' ALA . 20.6 p -117.45 161.76 19.06 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.205 -0.934 . . . . 0.0 109.946 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.1 mmtp -97.45 95.38 7.61 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.172 -0.955 . . . . 0.0 109.971 179.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.8 mtmm -116.89 132.28 56.74 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.217 -0.927 . . . . 0.0 110.176 -179.979 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.734 HG23 HD11 ' A' ' 76' ' ' LEU . 79.5 mt 52.93 94.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 120.982 -1.074 . . . . 0.0 110.596 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -113.04 133.64 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.193 -0.942 . . . . 0.0 109.837 179.572 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t70 52.7 -163.91 0.08 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.002 -1.061 . . . . 0.0 110.466 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.713 HD22 ' OG1' ' A' ' 91' ' ' THR . 17.0 tp -110.64 -59.5 1.94 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 81.96 0.1 Allowed 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.131 -0.981 . . . . 0.0 109.343 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -166.27 -53.42 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.329 -0.857 . . . . 0.0 110.647 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.777 HD22 ' HB3' ' A' ' 6' ' ' PHE . 94.9 mt -62.38 150.94 38.28 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.262 -0.899 . . . . 0.0 109.462 179.568 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -78.8 118.23 20.66 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.137 -0.977 . . . . 0.0 110.516 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.65 -41.04 0.95 Allowed Glycine 0 N--CA 1.492 2.406 0 C-N-CA 119.646 -1.264 . . . . 0.0 110.942 179.313 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.416 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 30.1 p-90 -57.62 -28.78 63.98 Favored 'General case' 0 N--CA 1.512 2.669 0 CA-C-N 118.838 1.319 . . . . 0.0 111.157 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.1 tp10 -53.66 -27.63 28.6 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.819 -1.176 . . . . 0.0 111.462 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -109.42 24.33 13.24 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.717 -1.239 . . . . 0.0 112.302 -179.342 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.676 HD22 ' HB2' ' A' ' 10' ' ' TYR . 23.8 mt -111.79 -163.33 0.84 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.701 -1.249 . . . . 0.0 109.5 179.283 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -99.64 162.02 13.26 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.93 -1.106 . . . . 0.0 110.47 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.11 -46.98 26.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.263 -0.898 . . . . 0.0 110.08 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -61.52 -46.16 91.14 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.24 -0.913 . . . . 0.0 109.426 179.753 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.452 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 23.1 mt-10 -62.15 -39.91 94.21 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.274 179.095 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.623 ' HA ' HD12 ' A' ' 90' ' ' ILE . 13.6 mtmt -56.0 -37.97 69.84 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.201 -0.937 . . . . 0.0 109.763 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.41 -38.67 74.68 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.224 -0.923 . . . . 0.0 109.879 179.299 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -59.65 -40.73 88.65 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 109.88 179.634 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' A' ' 87' ' ' LYS . 19.2 mt -65.61 -38.29 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 121.317 -0.864 . . . . 0.0 109.399 179.312 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.713 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -60.52 -38.51 84.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.989 -1.069 . . . . 0.0 109.497 179.042 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -56.82 -38.14 72.18 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.224 -0.923 . . . . 0.0 109.873 179.213 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.511 ' ND1' HG22 ' A' ' 53' ' ' ILE . 2.7 m-70 -56.32 -51.39 68.39 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.092 -1.005 . . . . 0.0 109.777 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.412 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.9 mp -62.29 -38.77 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.256 -0.903 . . . . 0.0 109.324 179.524 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.58 -40.95 89.17 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.204 -0.935 . . . . 0.0 109.526 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.19 -41.83 99.25 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.059 179.177 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.756 HD11 ' HG2' ' A' ' 61' ' ' GLU . 2.3 tp -76.26 -35.03 59.14 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.338 -0.851 . . . . 0.0 109.695 178.875 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.4 m -106.44 66.85 0.71 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.053 -1.029 . . . . 0.0 110.041 179.626 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.01 167.27 10.59 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.06 -1.025 . . . . 0.0 110.052 179.765 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -116.95 -177.79 3.28 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.221 -0.924 . . . . 0.0 110.458 -179.79 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -126.54 -163.69 1.26 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.315 -0.866 . . . . 0.0 110.006 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -109.59 93.46 4.52 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.134 -0.979 . . . . 0.0 110.148 179.842 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.03 137.57 9.75 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 7.3 t -140.98 147.55 48.36 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.167 -1.196 . . . . 0.0 110.249 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -74.14 -44.27 0.46 Allowed 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.343 1.181 . . . . 0.0 110.538 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.5 pttt -147.63 -172.75 4.11 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.209 -0.932 . . . . 0.0 110.512 -179.914 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 39.5 tttt -140.15 114.07 8.89 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.272 -0.892 . . . . 0.0 110.123 -179.981 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -126.29 48.36 2.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.154 -0.966 . . . . 0.0 110.212 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -128.8 107.65 9.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.17 -0.956 . . . . 0.0 110.21 -179.959 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.5 t -117.23 132.11 67.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.221 -0.925 . . . . 0.0 109.941 -179.947 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -126.25 125.64 68.02 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.243 -0.911 . . . . 0.0 110.009 179.945 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -129.14 145.92 51.19 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.25 -0.907 . . . . 0.0 110.279 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.48 107.28 9.6 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.251 -0.905 . . . . 0.0 110.249 -179.995 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -119.4 99.71 6.85 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.224 -0.922 . . . . 0.0 110.215 179.952 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.6 tp -119.99 146.8 45.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.237 -0.915 . . . . 0.0 110.272 179.973 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 p -133.09 139.31 47.07 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.195 -0.94 . . . . 0.0 110.222 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 39.1 p . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.199 179.976 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ttp . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 120.7 0.286 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.91 178.71 5.36 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.182 -0.949 . . . . 0.0 110.206 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -126.6 -59.91 1.27 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.227 -0.921 . . . . 0.0 110.163 -180.0 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -135.05 143.93 46.99 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.314 -0.866 . . . . 0.0 110.201 179.985 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -115.97 152.47 33.42 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.195 -0.94 . . . . 0.0 110.301 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.535 ' CD1' HD11 ' A' ' 70' ' ' ILE . 0.6 OUTLIER -144.93 135.59 24.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.375 -0.828 . . . . 0.0 109.781 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.487 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.8 m -153.24 165.56 35.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.059 179.227 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.577 HG13 ' HB2' ' A' ' 77' ' ' GLU . 10.2 m -100.75 120.33 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.052 -1.03 . . . . 0.0 110.224 179.451 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.437 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 0.6 OUTLIER -115.15 99.29 7.32 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.102 -0.999 . . . . 0.0 110.099 179.838 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.684 ' CD2' HD13 ' A' ' 82' ' ' LEU . 40.3 m-85 -52.61 156.16 1.97 Allowed 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.144 -0.973 . . . . 0.0 110.427 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.443 ' HB2' ' CG2' ' A' ' 25' ' ' ILE . . . -93.26 112.66 24.65 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.39 -0.819 . . . . 0.0 110.332 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -148.12 38.99 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.309 -0.87 . . . . 0.0 110.416 179.97 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 ttp85 -151.52 39.42 0.65 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.15 -0.969 . . . . 0.0 110.595 -179.942 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.84 -171.43 14.52 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 179.943 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.567 HG23 HG22 ' A' ' 26' ' ' VAL . 61.2 m -117.59 142.85 46.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.251 179.991 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.0 140.0 25.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.998 . . . . 0.0 110.91 -179.968 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.19 140.58 44.81 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 108.614 -1.795 . . . . 0.0 108.614 179.254 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.493 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 21.1 p -80.65 125.32 29.87 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.096 -1.238 . . . . 0.0 111.081 -178.882 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 156.99 38.0 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.839 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.54 16.15 10.37 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.813 -1.18 . . . . 0.0 111.411 -178.68 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.0 p -176.46 152.37 1.06 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.528 -1.357 . . . . 0.0 110.589 177.997 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 tptm -88.91 91.42 8.82 Favored 'General case' 0 N--CA 1.512 2.663 0 O-C-N 120.969 -1.082 . . . . 0.0 111.598 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.428 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.9 tt0 -168.35 -174.41 2.25 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.247 -0.908 . . . . 0.0 110.577 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.5 mttp -128.49 152.76 47.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.001 -1.062 . . . . 0.0 109.709 179.825 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.584 HD13 ' HD3' ' A' ' 31' ' ' ARG . 61.3 mt -107.75 98.85 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.222 -0.924 . . . . 0.0 109.959 -179.982 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.64 ' O ' HG12 ' A' ' 29' ' ' VAL . 60.1 t -105.08 160.58 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.33 -0.856 . . . . 0.0 110.006 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -48.28 134.23 14.87 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 121.442 -0.786 . . . . 0.0 111.085 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.18 6.67 44.87 Favored Glycine 0 N--CA 1.495 2.58 0 C-N-CA 120.176 -1.011 . . . . 0.0 111.496 -179.734 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.64 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.4 p -125.59 137.49 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-N 119.681 1.741 . . . . 0.0 110.45 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 t -92.19 136.35 33.25 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.181 -0.949 . . . . 0.0 110.074 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.584 ' HD3' HD13 ' A' ' 25' ' ' ILE . 5.9 ptt-85 -135.27 149.14 49.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.487 HG23 ' O ' ' A' ' 7' ' ' CYS . 15.6 mt -110.18 126.68 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.181 -0.949 . . . . 0.0 109.784 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.419 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.75 145.16 15.89 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.677 -1.769 . . . . 0.0 108.677 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 28.2 ttpt -111.95 125.08 53.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.192 -1.181 . . . . 0.0 109.057 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.487 HG22 ' HB3' ' A' ' 48' ' ' LYS . 59.7 t -100.26 109.58 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.072 -1.018 . . . . 0.0 110.506 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.59 134.89 24.72 Favored Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.205 -0.934 . . . . 0.0 109.818 179.637 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.24 127.78 11.54 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.107 1.056 . . . . 0.0 110.207 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -104.05 116.79 60.95 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.146 -0.971 . . . . 0.0 110.186 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.93 80.84 2.32 Favored 'Trans proline' 0 C--N 1.32 -0.957 0 O-C-N 123.177 1.093 . . . . 0.0 110.312 179.788 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -145.68 -58.86 0.33 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.191 -0.943 . . . . 0.0 110.433 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.24 157.28 19.61 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.133 -0.979 . . . . 0.0 110.256 -179.867 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -96.23 -39.49 9.64 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.224 -0.923 . . . . 0.0 110.422 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 m -56.9 -39.75 75.01 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.01 -1.056 . . . . 0.0 110.186 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -77.59 -178.71 48.59 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -140.39 -88.36 0.15 Allowed Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -116.5 150.52 37.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.258 -1.143 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.3 mtt -111.99 147.39 36.04 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.234 -0.916 . . . . 0.0 110.203 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.487 ' HB3' HG22 ' A' ' 35' ' ' VAL . 5.0 ptpt -143.3 134.61 26.0 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.206 -0.934 . . . . 0.0 110.271 -179.937 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -112.15 159.57 18.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.754 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CZ3' ' HB2' ' A' ' 9' ' ' ASP . 9.1 m95 -110.7 113.77 26.63 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.024 -1.047 . . . . 0.0 111.311 -179.729 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.528 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.4 OUTLIER -126.13 170.07 12.17 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.27 177.205 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 68.1 m80 -89.21 161.32 16.5 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.836 -0.746 . . . . 0.0 110.463 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.483 HG22 ' ND1' ' A' ' 93' ' ' HIS . 27.9 mt -65.53 -47.14 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.078 178.405 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.2 tttt -61.42 -40.73 95.49 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.279 -0.968 . . . . 0.0 109.214 178.609 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.3 m -63.92 -43.71 95.1 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.316 -0.865 . . . . 0.0 109.013 178.952 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.406 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -73.34 -45.58 54.28 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.431 -0.793 . . . . 0.0 109.775 179.938 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.467 ' CE2' HG23 ' A' ' 53' ' ' ILE . 10.6 m-85 -65.48 -28.81 69.47 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.618 179.033 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -64.47 -41.99 96.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.831 -1.168 . . . . 0.0 109.034 178.903 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.1 tptt -72.56 -41.44 65.76 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.375 -0.93 . . . . 0.0 108.702 178.399 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -39.95 94.11 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.529 -0.868 . . . . 0.0 108.857 178.62 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.05 -32.3 66.06 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.128 -0.982 . . . . 0.0 109.663 178.435 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -102.36 28.82 5.61 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.174 -0.954 . . . . 0.0 110.749 179.219 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.73 167.32 10.32 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.794 -1.191 . . . . 0.0 110.356 179.837 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -66.68 157.78 31.75 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.17 -0.956 . . . . 0.0 110.152 -179.876 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.2 -34.34 37.45 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.212 -0.93 . . . . 0.0 110.7 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.3 m -51.22 -34.42 32.02 Favored 'General case' 0 N--CA 1.514 2.773 0 O-C-N 120.96 -1.088 . . . . 0.0 110.941 -179.863 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -109.65 102.35 11.18 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.07 -1.019 . . . . 0.0 110.242 179.82 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -115.9 144.85 43.47 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.202 -0.937 . . . . 0.0 109.962 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mttp -125.7 149.38 48.54 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.133 -0.98 . . . . 0.0 110.605 -179.701 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 6' ' ' PHE . 78.4 mt 54.35 101.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.258 -0.901 . . . . 0.0 111.093 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -112.22 146.65 37.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.319 -0.863 . . . . 0.0 109.014 178.826 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t0 53.81 -161.7 0.12 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.922 -1.111 . . . . 0.0 110.148 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' A' ' 87' ' ' LYS . 4.8 tp -112.54 -60.0 1.93 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.952 -1.092 . . . . 0.0 110.614 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.553 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -72.72 73.36 1.08 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.162 -0.962 . . . . 0.0 109.925 -179.749 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.479 ' CB ' HD23 ' A' ' 76' ' ' LEU . 2.8 mt-10 -129.15 -58.35 1.14 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.19 -0.944 . . . . 0.0 110.309 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.647 HD23 ' N ' ' A' ' 76' ' ' LEU . 1.3 pt? -147.87 63.83 1.12 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.968 -1.083 . . . . 0.0 110.796 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.577 ' HB2' HG13 ' A' ' 8' ' ' VAL . 8.7 pt-20 -144.42 140.2 28.85 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.01 -1.056 . . . . 0.0 110.266 178.299 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.611 ' O ' HD12 ' A' ' 82' ' ' LEU . . . -72.59 69.01 1.2 Allowed Glycine 0 N--CA 1.498 2.814 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.763 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.553 ' CE2' HG22 ' A' ' 74' ' ' THR . 59.5 p-90 -92.49 -36.25 13.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.118 -1.224 . . . . 0.0 110.805 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -53.17 -28.92 28.86 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.057 -1.027 . . . . 0.0 111.363 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -96.38 -34.88 11.38 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.889 -1.132 . . . . 0.0 111.18 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.684 HD13 ' CD2' ' A' ' 10' ' ' TYR . 61.3 mt -74.7 -173.8 1.94 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.956 -1.09 . . . . 0.0 110.256 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.3 152.67 33.06 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.193 -0.942 . . . . 0.0 110.71 -179.399 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -89.78 -39.2 13.27 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.237 -0.914 . . . . 0.0 110.437 179.661 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.89 -44.25 86.59 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.046 -1.033 . . . . 0.0 109.971 -179.882 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.454 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.3 mt-10 -60.52 -39.81 89.17 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.444 179.175 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.75 ' HG2' HD21 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -55.78 -38.19 69.57 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.904 179.182 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -41.66 90.15 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.865 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.45 -32.7 72.69 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.267 -0.896 . . . . 0.0 110.656 179.858 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.61 ' HB ' HD11 ' A' ' 73' ' ' LEU . 97.2 mt -65.12 -39.0 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 120.979 -1.076 . . . . 0.0 109.675 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.639 ' OG1' HD22 ' A' ' 73' ' ' LEU . 41.6 m -59.01 -39.09 80.82 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.964 -1.085 . . . . 0.0 109.892 179.649 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -56.32 -37.28 69.72 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.203 -0.936 . . . . 0.0 109.975 179.374 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.483 ' ND1' HG22 ' A' ' 53' ' ' ILE . 2.5 m-70 -57.46 -51.96 67.32 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.01 . . . . 0.0 110.008 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.3 mp -64.24 -38.62 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.31 179.642 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.66 81.43 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.203 -0.935 . . . . 0.0 109.741 179.118 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -66.57 -39.55 88.52 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.179 -0.951 . . . . 0.0 109.873 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -74.31 -34.73 63.57 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.281 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 74.8 m -96.53 58.09 1.69 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.027 -1.045 . . . . 0.0 110.094 179.762 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 90.9 p -136.34 39.77 2.67 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.131 -0.981 . . . . 0.0 110.253 179.934 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -140.45 99.92 3.76 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.116 -0.99 . . . . 0.0 110.212 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 52.69 81.22 0.09 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.014 -1.054 . . . . 0.0 110.918 -179.961 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.19 -172.19 2.26 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.189 -0.945 . . . . 0.0 110.201 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -107.58 156.58 15.83 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 19.5 p -141.04 94.86 7.72 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.19 -1.182 . . . . 0.0 110.237 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.81 76.38 2.47 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.425 1.224 . . . . 0.0 110.377 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -140.6 93.54 2.62 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.15 -0.969 . . . . 0.0 110.182 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -119.13 144.7 46.49 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.252 -0.905 . . . . 0.0 110.269 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -117.96 127.09 53.49 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.19 -0.944 . . . . 0.0 110.174 -179.998 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -120.74 167.01 12.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.183 -0.948 . . . . 0.0 110.195 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.74 127.15 73.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.21 -0.931 . . . . 0.0 109.913 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.7 t -115.94 120.71 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.151 -0.968 . . . . 0.0 110.087 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -117.03 128.29 55.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 110.142 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.53 136.35 53.31 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.187 -0.945 . . . . 0.0 110.311 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -121.47 128.33 52.0 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.24 -0.912 . . . . 0.0 110.13 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.88 152.89 32.53 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.187 -0.946 . . . . 0.0 110.157 -179.99 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 24.2 m -117.4 131.66 56.72 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.187 -0.946 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.168 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 mtt . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.83 123.19 15.87 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.142 -0.974 . . . . 0.0 110.28 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -136.24 145.25 45.41 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.178 -0.951 . . . . 0.0 110.227 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -138.08 133.59 33.66 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.146 -0.971 . . . . 0.0 110.215 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.99 151.51 36.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.25 -0.906 . . . . 0.0 110.215 -179.943 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.731 ' O ' HD12 ' A' ' 76' ' ' LEU . 1.1 m-85 -149.27 136.45 19.93 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.304 -0.873 . . . . 0.0 110.205 -179.65 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' ILE . 26.2 p -151.93 157.66 42.1 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.227 -0.921 . . . . 0.0 109.807 178.735 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.753 HG22 ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -102.3 141.44 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.834 -1.166 . . . . 0.0 110.798 179.869 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -141.97 148.24 38.27 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.269 -0.894 . . . . 0.0 109.607 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.443 ' CD2' HD11 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -96.02 151.61 19.29 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.085 -1.01 . . . . 0.0 109.873 179.917 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HB2' ' HD2' ' A' ' 31' ' ' ARG . . . -92.95 147.14 23.09 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.289 -0.882 . . . . 0.0 110.546 -179.578 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -120.1 -57.83 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.29 -0.881 . . . . 0.0 110.056 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -139.29 132.54 29.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.184 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.15 164.67 14.49 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 179.898 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.9 m -135.0 143.71 46.97 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -1.159 . . . . 0.0 110.258 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.32 143.82 34.26 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.222 -0.924 . . . . 0.0 110.884 -179.85 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.05 127.87 13.46 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.09 130.39 44.45 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.358 -1.084 . . . . 0.0 109.381 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.443 ' HB3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -61.92 147.86 45.45 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 109.212 179.793 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 mttt 52.6 45.41 28.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.905 -1.122 . . . . 0.0 109.591 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 31.6 t -164.89 144.72 7.14 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.386 -0.821 . . . . 0.0 110.769 -178.156 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.75 56.71 1.29 Allowed 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -145.63 -172.05 3.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.374 -0.829 . . . . 0.0 110.238 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -135.31 159.29 42.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.193 -0.942 . . . . 0.0 109.629 -179.6 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.684 HG21 ' HG2' ' A' ' 31' ' ' ARG . 74.3 mt -107.92 119.36 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.41 -0.806 . . . . 0.0 110.057 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.686 ' O ' HG12 ' A' ' 29' ' ' VAL . 32.4 m -118.7 166.2 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.202 -0.936 . . . . 0.0 110.584 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -48.13 143.28 4.57 Favored 'General case' 0 N--CA 1.515 2.784 0 O-C-N 121.512 -0.742 . . . . 0.0 111.023 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 96.3 5.83 59.07 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.15 -1.024 . . . . 0.0 111.239 -179.362 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 26' ' ' VAL . 7.1 p -126.89 133.63 68.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 119.545 1.673 . . . . 0.0 109.977 179.796 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.657 ' HB3' HD11 ' A' ' 53' ' ' ILE . 43.2 t -81.13 139.31 35.69 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.052 -1.03 . . . . 0.0 109.341 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.74 ' HD2' ' HB2' ' A' ' 11' ' ' ALA . 7.8 mtp180 -124.21 142.9 50.85 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.176 -0.952 . . . . 0.0 110.697 -178.731 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.548 HD12 ' HG2' ' A' ' 56' ' ' MET . 22.9 mt -96.74 129.01 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.105 -0.997 . . . . 0.0 109.375 178.722 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.9 122.72 7.7 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 58.4 tttt -106.25 122.07 45.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.217 -1.166 . . . . 0.0 109.703 -179.79 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -101.0 115.54 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.996 . . . . 0.0 110.361 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.2 t -120.73 111.67 34.33 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.214 -0.929 . . . . 0.0 109.762 179.826 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.08 131.01 14.91 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.131 1.069 . . . . 0.0 110.431 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -103.98 117.13 60.34 Favored Pre-proline 0 N--CA 1.501 2.076 0 O-C-N 121.231 -0.918 . . . . 0.0 110.035 179.734 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.53 70.62 4.87 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 O-C-N 123.207 1.109 . . . . 0.0 110.39 179.813 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.484 ' HD2' ' HG ' ' A' ' 41' ' ' SER . 84.6 t80 -147.67 -59.14 0.26 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.071 -1.018 . . . . 0.0 110.482 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.484 ' HG ' ' HD2' ' A' ' 40' ' ' PHE . 65.9 m -109.42 157.94 18.43 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.157 -0.964 . . . . 0.0 110.278 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -94.58 -38.89 10.65 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.291 -0.881 . . . . 0.0 110.331 179.854 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.26 -40.07 76.9 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.051 -1.03 . . . . 0.0 110.118 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.43 84.28 0.9 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.85 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.69 -74.1 0.43 Allowed Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 -179.807 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -133.47 151.17 51.75 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.216 -1.167 . . . . 0.0 110.466 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttt -110.91 142.8 42.49 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.337 -0.852 . . . . 0.0 110.019 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -119.6 124.84 47.34 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.166 -0.959 . . . . 0.0 110.328 -179.769 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -112.15 146.88 37.26 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.142 -0.974 . . . . 0.0 109.627 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 18.0 m95 -98.88 128.17 44.99 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.181 -0.95 . . . . 0.0 110.281 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.443 ' CE2' ' HB3' ' A' ' 19' ' ' LYS . 86.9 m-85 -111.56 172.8 6.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -90.25 -173.09 3.7 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.534 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.891 HG22 ' CE1' ' A' ' 93' ' ' HIS . 40.5 mm -87.28 -38.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.005 -1.06 . . . . 0.0 109.332 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -88.13 -29.33 20.66 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.73 -1.231 . . . . 0.0 110.915 179.116 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.6 m -65.9 -51.66 56.71 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.835 -1.166 . . . . 0.0 110.487 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.548 ' HG2' HD12 ' A' ' 32' ' ' ILE . 10.6 tpt -66.59 -39.75 88.56 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.178 -179.509 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.458 ' HD1' HD22 ' A' ' 97' ' ' LEU . 6.7 m-85 -72.87 -30.56 64.08 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.792 179.191 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -67.75 -36.71 81.03 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.918 -1.114 . . . . 0.0 109.639 178.784 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -39.87 86.73 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.045 -1.034 . . . . 0.0 109.82 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -59.08 -43.39 91.8 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.248 179.351 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.5 ' HG3' HD11 ' A' ' 97' ' ' LEU . 3.8 mt-10 -57.82 -34.67 69.92 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.194 -0.941 . . . . 0.0 109.484 178.497 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 6.9 ttm105 -103.78 30.77 4.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.399 179.037 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -102.37 170.28 8.16 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.917 -1.115 . . . . 0.0 109.945 179.643 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 4.7 mmm180 -60.71 155.59 18.81 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.156 -0.965 . . . . 0.0 110.069 -179.678 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.79 -33.64 76.47 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.227 -0.921 . . . . 0.0 110.804 -179.79 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 41.7 p -96.96 58.26 1.58 Allowed 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.935 -1.103 . . . . 0.0 110.229 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.2 m -115.95 157.94 23.81 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.183 -0.948 . . . . 0.0 110.105 179.841 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -136.02 100.49 4.44 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.203 -0.936 . . . . 0.0 110.193 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.05 108.83 5.95 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.235 -0.915 . . . . 0.0 110.277 -179.876 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.9 mt 54.28 99.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.163 -0.961 . . . . 0.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -112.79 134.86 54.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.209 -0.932 . . . . 0.0 109.647 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 t70 53.74 -165.18 0.09 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.964 -1.085 . . . . 0.0 110.451 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.848 HD13 HG22 ' A' ' 91' ' ' THR . 0.3 OUTLIER -114.26 -176.97 3.02 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.103 -0.998 . . . . 0.0 110.218 179.913 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.593 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.5 OUTLIER 46.73 37.3 4.54 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.154 -0.966 . . . . 0.0 111.425 -179.777 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.512 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.9 mm-40 -111.45 -60.05 1.9 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.599 179.547 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.731 HD12 ' O ' ' A' ' 6' ' ' PHE . 1.1 pt? -143.42 62.3 1.38 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.214 -0.929 . . . . 0.0 109.772 178.681 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.753 ' HB2' HG22 ' A' ' 8' ' ' VAL . 12.8 pt-20 -144.92 141.26 28.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.754 -1.216 . . . . 0.0 111.002 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.02 70.12 1.24 Allowed Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.806 -1.718 . . . . 0.0 108.806 178.859 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.593 ' CE2' HG22 ' A' ' 74' ' ' THR . 60.7 p-90 -90.7 -23.55 20.69 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.313 -1.11 . . . . 0.0 111.787 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -51.77 -32.0 29.15 Favored 'General case' 0 N--CA 1.514 2.756 0 O-C-N 120.702 -1.248 . . . . 0.0 110.768 179.741 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -83.48 -38.6 21.61 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.917 -1.115 . . . . 0.0 109.892 179.243 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.443 HD11 ' CD2' ' A' ' 10' ' ' TYR . 0.2 OUTLIER -51.76 178.63 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.84 0 O-C-N 121.062 -1.024 . . . . 0.0 110.508 -179.925 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -105.68 160.85 14.89 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.127 -0.983 . . . . 0.0 110.415 179.872 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -58.72 -39.79 81.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.272 -0.892 . . . . 0.0 110.403 -179.646 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -66.38 -42.41 87.99 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.249 -0.907 . . . . 0.0 109.705 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.413 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 20.3 mt-10 -66.63 -39.29 88.24 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.513 -0.875 . . . . 0.0 109.416 179.234 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.724 ' HA ' HD12 ' A' ' 90' ' ' ILE . 16.2 ttpp -61.38 -39.08 89.35 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.843 179.334 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 13.6 tt0 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.165 -0.96 . . . . 0.0 110.063 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -63.8 -39.29 93.89 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.151 -0.968 . . . . 0.0 110.083 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.724 HD12 ' HA ' ' A' ' 87' ' ' LYS . 8.3 mt -67.17 -41.15 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.417 0 O-C-N 121.216 -0.928 . . . . 0.0 109.379 179.495 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.848 HG22 HD13 ' A' ' 73' ' ' LEU . 30.5 p -60.83 -38.32 85.08 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.166 -0.959 . . . . 0.0 109.802 179.437 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -57.6 -39.89 77.84 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.113 -0.992 . . . . 0.0 109.845 179.533 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.891 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.8 m-70 -60.2 -52.99 62.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.19 -0.943 . . . . 0.0 109.702 179.651 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.603 ' CD1' HD12 ' A' ' 73' ' ' LEU . 7.9 mt -63.28 -39.21 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 C-N-CA 119.352 -0.939 . . . . 0.0 109.414 179.46 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.02 -41.14 91.37 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.179 -0.95 . . . . 0.0 109.219 178.997 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -71.07 -42.6 69.19 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.201 -0.937 . . . . 0.0 108.703 178.731 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.5 HD11 ' HG3' ' A' ' 61' ' ' GLU . 2.5 tp -62.53 -34.11 76.25 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.323 -0.861 . . . . 0.0 109.974 178.94 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.4 t -96.92 52.66 1.18 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.115 -0.991 . . . . 0.0 110.165 179.754 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 t -133.07 116.15 15.99 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.91 -64.11 1.36 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.202 -0.936 . . . . 0.0 110.191 -179.885 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -117.09 136.58 52.88 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.234 -0.916 . . . . 0.0 110.238 -179.933 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.76 118.61 20.17 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.294 -0.879 . . . . 0.0 110.21 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.46 154.23 42.21 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 4.2 p -116.68 138.45 24.56 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.174 -1.192 . . . . 0.0 110.121 179.993 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -74.31 153.37 45.42 Favored 'Trans proline' 0 C--N 1.318 -1.033 0 O-C-N 123.311 1.164 . . . . 0.0 110.42 -179.97 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -127.89 85.75 2.39 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.202 -0.936 . . . . 0.0 110.065 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? 52.84 60.22 3.93 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.041 -1.037 . . . . 0.0 110.644 -179.971 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -116.24 -175.58 2.78 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.22 -0.925 . . . . 0.0 110.181 -179.98 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.2 106.05 11.15 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.122 -0.986 . . . . 0.0 110.199 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.8 t -128.35 117.72 46.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.104 -0.998 . . . . 0.0 109.933 179.956 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.4 t -124.66 136.16 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.171 -0.955 . . . . 0.0 109.993 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -125.87 113.21 16.92 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.289 -0.882 . . . . 0.0 110.21 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -120.93 100.72 7.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.165 -0.96 . . . . 0.0 110.189 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.81 150.93 47.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.246 -0.909 . . . . 0.0 110.331 179.803 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.7 mt -126.12 150.19 48.4 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.197 -0.94 . . . . 0.0 110.312 -179.889 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 40.8 p -118.79 134.48 55.11 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.187 -0.946 . . . . 0.0 110.199 179.982 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.6 p . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.244 -179.989 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.06 -177.98 5.07 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.258 -0.901 . . . . 0.0 110.272 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -123.5 78.56 1.6 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.251 -0.906 . . . . 0.0 110.155 179.972 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.441 ' CB ' HG22 ' A' ' 36' ' ' VAL . 39.8 mt-30 -125.71 158.78 33.95 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.143 -0.973 . . . . 0.0 110.199 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.7 156.67 37.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.179 -0.95 . . . . 0.0 110.395 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.511 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -147.34 136.63 22.54 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.423 -0.798 . . . . 0.0 109.915 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.497 ' O ' HG23 ' A' ' 32' ' ' ILE . 26.3 p -152.83 160.93 43.11 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 110.027 178.957 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.67 HG22 ' HB2' ' A' ' 77' ' ' GLU . 6.8 m -101.98 122.57 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 120.926 -1.109 . . . . 0.0 110.612 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.71 154.99 34.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.103 -0.998 . . . . 0.0 110.223 179.58 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.53 149.48 27.09 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.487 -0.758 . . . . 0.0 110.075 -179.798 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.484 ' HB2' HH11 ' A' ' 31' ' ' ARG . . . -111.16 126.29 54.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.244 -0.91 . . . . 0.0 110.127 179.8 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -116.61 -56.18 2.3 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.262 -0.899 . . . . 0.0 110.277 -179.916 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -117.39 93.18 4.07 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.156 -0.965 . . . . 0.0 110.307 -179.966 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.44 126.74 2.29 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.846 HG22 ' HA ' ' A' ' 26' ' ' VAL . 77.2 p -115.58 145.59 42.53 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.202 -1.175 . . . . 0.0 110.07 179.881 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.92 145.54 28.66 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.195 -0.941 . . . . 0.0 110.879 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.34 130.44 47.7 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 31.1 p -69.6 117.13 10.82 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.28 -1.129 . . . . 0.0 111.014 -178.722 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 11.8 mmtt -64.59 157.28 27.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.15 -0.969 . . . . 0.0 109.547 179.849 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.52 18.42 11.05 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.519 -1.363 . . . . 0.0 111.395 -178.909 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.2 p -175.18 143.65 0.69 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.576 -1.328 . . . . 0.0 110.663 178.13 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.87 84.69 7.3 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.017 -1.052 . . . . 0.0 111.914 -177.861 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.403 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 1.3 tt0 -163.6 -174.71 3.83 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 178.687 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.4 ttmm -129.69 156.57 44.04 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.002 -1.061 . . . . 0.0 109.983 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.632 HG23 ' CG1' ' A' ' 29' ' ' VAL . 75.4 mt -109.14 129.53 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.846 ' HA ' HG22 ' A' ' 15' ' ' THR . 33.3 m -125.17 160.39 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.174 -0.954 . . . . 0.0 110.238 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -46.29 134.67 8.62 Favored 'General case' 0 N--CA 1.518 2.931 0 O-C-N 121.43 -0.794 . . . . 0.0 111.452 -179.321 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.43 10.39 44.66 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.386 -179.623 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.632 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.8 p -125.53 135.9 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 CA-C-N 119.667 1.733 . . . . 0.0 110.424 -179.85 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 45.1 t -92.24 130.28 37.98 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.192 -0.943 . . . . 0.0 109.511 179.26 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.515 ' HD2' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -125.26 150.85 46.67 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.233 -0.917 . . . . 0.0 110.538 -179.693 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.497 HG23 ' O ' ' A' ' 7' ' ' CYS . 22.1 mt -101.65 129.12 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.275 -0.891 . . . . 0.0 109.644 179.747 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.438 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.63 129.67 9.93 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.258 -1.537 . . . . 0.0 109.258 179.967 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 11.4 ttpt -101.85 121.26 41.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.302 -1.116 . . . . 0.0 109.066 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.504 HG22 ' HG3' ' A' ' 48' ' ' LYS . 56.0 t -102.71 110.51 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.022 -1.049 . . . . 0.0 110.552 -179.446 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.441 HG22 ' CB ' ' A' ' 4' ' ' GLN . 57.5 t -121.32 112.09 33.15 Favored Pre-proline 0 N--CA 1.496 1.855 0 O-C-N 121.265 -0.897 . . . . 0.0 109.568 179.612 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.26 126.49 11.11 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.116 1.061 . . . . 0.0 110.451 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -105.2 115.74 61.67 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 121.252 -0.905 . . . . 0.0 110.183 179.671 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -78.2 80.87 2.88 Favored 'Trans proline' 0 C--N 1.321 -0.905 0 O-C-N 123.125 1.066 . . . . 0.0 110.299 179.66 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -152.76 -57.7 0.13 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.046 -1.034 . . . . 0.0 110.86 -179.72 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.0 p -99.55 157.86 16.15 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.106 -0.996 . . . . 0.0 110.338 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -96.27 -41.72 8.52 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.205 -0.935 . . . . 0.0 110.317 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -56.27 -39.7 73.06 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.128 -0.982 . . . . 0.0 110.233 -179.922 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -94.97 155.33 21.48 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 179.729 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.95 -72.81 0.1 OUTLIER Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.957 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.489 ' OD1' HG12 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -114.51 148.4 37.96 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.21 -1.171 . . . . 0.0 110.105 -179.94 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.9 mtt -114.99 119.78 37.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.293 -0.879 . . . . 0.0 110.274 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HG3' HG22 ' A' ' 35' ' ' VAL . 26.3 ttmt -116.1 127.96 55.28 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.208 -0.932 . . . . 0.0 109.988 179.829 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -114.59 124.99 53.24 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.438 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 17.6 m95 -89.01 126.69 35.53 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.187 -0.946 . . . . 0.0 110.057 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.511 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 1.0 OUTLIER -147.21 170.46 17.2 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.527 178.68 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 57.1 m80 -74.72 179.69 4.64 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.658 -0.651 . . . . 0.0 111.217 -178.414 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.522 HG22 ' ND1' ' A' ' 93' ' ' HIS . 33.6 mm -88.57 -48.92 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 179.044 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -60.46 -38.6 84.71 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.342 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.1 m -61.69 -50.01 74.21 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.238 -0.914 . . . . 0.0 109.068 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.4 tpt -68.91 -45.49 70.76 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.729 -0.789 . . . . 0.0 109.385 179.577 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -63.95 -30.47 71.55 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.615 178.926 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -60.43 -39.79 88.74 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.883 -1.136 . . . . 0.0 109.62 179.143 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.408 179.251 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -59.83 -42.61 93.91 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.126 -0.984 . . . . 0.0 109.173 179.23 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -58.51 -34.49 71.01 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.229 -0.92 . . . . 0.0 109.661 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -105.42 30.19 5.88 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.208 -0.932 . . . . 0.0 110.723 179.261 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -113.11 167.26 10.69 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 110.104 179.854 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.07 156.28 28.72 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.113 -0.992 . . . . 0.0 110.083 -179.853 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.32 -34.21 21.91 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.197 -0.939 . . . . 0.0 110.584 179.802 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.1 -35.89 37.54 Favored 'General case' 0 N--CA 1.514 2.757 0 O-C-N 120.896 -1.128 . . . . 0.0 110.872 -179.84 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.9 p -107.9 118.6 37.16 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.1 -1.0 . . . . 0.0 110.028 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -115.85 143.96 44.69 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.149 -0.97 . . . . 0.0 110.296 -179.949 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.01 139.42 53.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.242 -0.911 . . . . 0.0 110.055 -179.991 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.07 98.25 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.232 -0.917 . . . . 0.0 110.689 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -109.51 134.63 51.66 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.228 -0.92 . . . . 0.0 109.544 179.339 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.405 ' HA ' HG21 ' A' ' 94' ' ' ILE . 0.2 OUTLIER 54.37 -165.36 0.1 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.956 -1.09 . . . . 0.0 110.203 -179.534 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.81 HD11 HG22 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -116.16 -172.41 2.17 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.122 -0.986 . . . . 0.0 110.201 179.872 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.627 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.7 OUTLIER 46.9 37.1 4.51 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.114 -0.992 . . . . 0.0 111.296 -179.577 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.783 ' HB3' HD23 ' A' ' 76' ' ' LEU . 10.4 tt0 -109.81 -58.3 2.07 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.153 -0.967 . . . . 0.0 109.652 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.783 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.2 pt? -145.23 62.2 1.29 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.093 -1.004 . . . . 0.0 109.861 178.668 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.67 ' HB2' HG22 ' A' ' 8' ' ' VAL . 12.4 pt-20 -143.92 140.82 29.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.8 -1.188 . . . . 0.0 110.867 179.321 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.77 70.27 0.95 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.627 ' CE2' HG22 ' A' ' 74' ' ' THR . 61.8 p-90 -90.58 -23.4 20.86 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.23 -1.159 . . . . 0.0 111.644 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -52.47 -34.41 48.94 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.685 -1.259 . . . . 0.0 110.285 179.45 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.68 -39.03 20.71 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.088 -1.007 . . . . 0.0 109.635 178.972 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.12 177.21 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.046 -1.034 . . . . 0.0 110.42 179.787 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -101.31 160.56 14.31 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.137 -0.977 . . . . 0.0 110.413 179.855 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.7 -42.9 98.12 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.26 -0.9 . . . . 0.0 110.101 -179.888 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.69 -41.8 99.3 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.539 -0.865 . . . . 0.0 109.751 179.839 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.402 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 71.4 mt-10 -67.52 -40.56 85.1 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.523 -0.871 . . . . 0.0 109.253 179.109 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -61.3 -38.91 88.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.305 -0.872 . . . . 0.0 109.814 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -58.77 -39.75 81.93 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.258 -0.901 . . . . 0.0 109.922 179.743 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -60.52 -35.73 76.68 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.152 -0.967 . . . . 0.0 110.362 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.81 HG22 HD11 ' A' ' 73' ' ' LEU . 47.7 mm -69.28 -39.2 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.084 -1.01 . . . . 0.0 109.371 179.561 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 73.5 p -61.31 -39.18 89.52 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.023 -1.048 . . . . 0.0 109.603 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -57.61 -36.85 72.32 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.153 -0.967 . . . . 0.0 109.906 179.226 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.522 ' ND1' HG22 ' A' ' 53' ' ' ILE . 12.7 m-70 -59.37 -53.43 58.29 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.127 -0.983 . . . . 0.0 109.878 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.468 ' CD1' HD12 ' A' ' 73' ' ' LEU . 2.4 mp -63.29 -38.55 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.435 179.616 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.24 77.42 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.182 -0.949 . . . . 0.0 109.9 179.198 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.73 -38.4 73.56 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.13 -0.981 . . . . 0.0 109.712 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -78.9 -32.75 45.91 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.116 -0.99 . . . . 0.0 110.315 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.8 t -96.01 54.03 1.43 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.98 -1.075 . . . . 0.0 110.193 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.0 m -120.93 40.22 3.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.126 -0.984 . . . . 0.0 110.227 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -136.54 134.38 37.45 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.193 -0.942 . . . . 0.0 110.213 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -135.14 102.03 5.06 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.228 -0.92 . . . . 0.0 110.217 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.0 54.76 1.73 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.208 -0.932 . . . . 0.0 110.238 179.971 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 72.65 79.19 0.48 Allowed Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.0 p -125.69 150.38 68.2 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.291 -1.123 . . . . 0.0 110.275 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.76 175.72 9.91 Favored 'Trans proline' 0 C--N 1.317 -1.103 0 O-C-N 123.487 1.256 . . . . 0.0 110.434 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.3 mtmt -129.8 72.35 1.48 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.206 -0.934 . . . . 0.0 110.212 -179.919 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.0 tttt 52.38 38.97 26.54 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.979 -1.076 . . . . 0.0 110.758 -179.916 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -142.45 126.83 17.7 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.222 -0.924 . . . . 0.0 110.205 -179.953 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -119.92 104.88 10.55 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.171 -0.956 . . . . 0.0 110.225 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.3 t -130.12 99.99 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.308 -0.87 . . . . 0.0 109.968 179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.17 143.12 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.263 -0.898 . . . . 0.0 110.276 -179.936 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -129.49 90.38 2.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.237 -0.914 . . . . 0.0 110.247 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.75 123.13 44.08 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.15 -0.969 . . . . 0.0 110.236 -179.917 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -123.57 102.37 7.82 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.168 -0.958 . . . . 0.0 110.288 179.927 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 8.2 tp -122.4 111.97 17.51 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.191 -0.943 . . . . 0.0 110.158 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.5 t -141.84 146.87 36.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.193 -0.942 . . . . 0.0 110.319 -179.971 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 117' ' ' THR . . . . . 0.517 ' O ' HG22 ' A' ' 117' ' ' THR . 25.6 m . . . . . 0 N--CA 1.501 2.112 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.782 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.3 mtp . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -122.78 175.54 6.48 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.162 -0.961 . . . . 0.0 110.183 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -146.12 85.97 1.69 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.18 -0.95 . . . . 0.0 110.503 -179.897 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -117.88 159.38 23.2 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.169 -0.957 . . . . 0.0 110.019 179.842 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.22 145.04 51.05 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.948 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.522 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -150.24 137.6 19.66 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.286 -0.884 . . . . 0.0 109.726 -179.94 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.46 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.7 m -153.3 157.03 39.5 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.157 -0.964 . . . . 0.0 110.258 179.193 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 77' ' ' GLU . 5.7 m -100.98 135.09 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.308 0 O-C-N 121.004 -1.06 . . . . 0.0 110.505 179.637 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.52 157.71 46.21 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.335 -0.853 . . . . 0.0 110.133 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.441 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -107.17 154.91 20.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.407 -0.808 . . . . 0.0 110.085 -179.958 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.97 133.07 37.79 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.319 -0.863 . . . . 0.0 110.061 179.76 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 -55.44 2.44 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.27 -0.894 . . . . 0.0 110.456 -179.805 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 -138.51 105.87 5.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.166 -0.959 . . . . 0.0 110.29 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.75 151.56 6.04 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.421 HG23 HG12 ' A' ' 26' ' ' VAL . 83.8 m -116.11 142.23 47.09 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.226 -1.161 . . . . 0.0 110.033 179.897 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.23 129.74 27.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.141 -0.974 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.77 122.19 25.56 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -61.24 129.91 43.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -1.151 . . . . 0.0 109.441 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.441 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 14.9 tptt -61.98 147.42 47.05 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.168 179.827 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt 52.29 48.45 22.63 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.05 -1.031 . . . . 0.0 109.776 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.5 t -164.43 155.75 15.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.342 -0.849 . . . . 0.0 110.736 -178.147 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.87 44.25 1.04 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.27 -0.894 . . . . 0.0 108.604 178.629 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.35 -174.65 4.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.447 -0.783 . . . . 0.0 110.198 -179.045 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -136.46 156.62 48.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.091 -1.006 . . . . 0.0 109.743 -179.516 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.687 HG23 ' CG1' ' A' ' 29' ' ' VAL . 49.4 mt -97.58 121.56 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.645 179.875 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.421 HG12 HG23 ' A' ' 15' ' ' THR . 34.1 m -129.51 176.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.331 -0.855 . . . . 0.0 110.6 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -43.64 125.88 4.26 Favored 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.784 -0.573 . . . . 0.0 111.334 -179.544 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.16 8.58 50.2 Favored Glycine 0 N--CA 1.492 2.417 0 C-N-CA 120.151 -1.023 . . . . 0.0 110.955 -179.212 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.687 ' CG1' HG23 ' A' ' 25' ' ' ILE . 54.9 t -122.07 134.45 65.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-N 119.562 1.681 . . . . 0.0 109.869 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.701 ' HB3' HD11 ' A' ' 53' ' ' ILE . 51.4 t -96.36 138.03 34.56 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.25 -0.906 . . . . 0.0 108.64 178.516 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.525 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.9 ptt85 -136.05 151.05 49.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.128 -0.982 . . . . 0.0 111.151 -178.924 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.46 HG23 ' O ' ' A' ' 7' ' ' CYS . 20.5 mt -105.01 137.0 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.26 -0.9 . . . . 0.0 109.832 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.13 127.16 8.7 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 108.934 -1.666 . . . . 0.0 108.934 179.658 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB3' ' CE1' ' A' ' 6' ' ' PHE . 49.6 pttt -110.89 124.05 51.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.154 -1.203 . . . . 0.0 110.08 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -112.72 107.99 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.918 -1.114 . . . . 0.0 110.121 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -122.39 112.23 31.38 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.225 -0.922 . . . . 0.0 109.919 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.74 127.19 12.08 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.198 1.104 . . . . 0.0 110.206 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -104.18 118.85 55.91 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 121.112 -0.992 . . . . 0.0 110.162 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.23 71.45 2.97 Favored 'Trans proline' 0 N--CA 1.484 0.939 0 O-C-N 123.133 1.07 . . . . 0.0 110.304 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -145.87 -58.77 0.32 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.184 -0.947 . . . . 0.0 110.427 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 t -108.1 157.42 18.29 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.076 -1.015 . . . . 0.0 110.222 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -95.65 -39.09 10.08 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.26 -0.9 . . . . 0.0 110.36 -179.98 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -39.62 76.48 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.09 -1.007 . . . . 0.0 110.243 -179.934 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -108.04 81.31 0.29 Allowed Glycine 0 N--CA 1.493 2.499 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.937 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -73.63 -69.38 1.4 Allowed Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.49 133.88 55.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.148 -1.207 . . . . 0.0 110.256 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 37.5 mtt -117.52 138.49 51.86 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.169 -0.957 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 ttmm -117.23 125.77 51.69 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.187 -0.945 . . . . 0.0 109.996 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -114.81 134.6 54.99 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.181 -0.95 . . . . 0.0 109.946 179.91 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 42.2 m95 -93.09 126.93 38.43 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.31 -0.869 . . . . 0.0 109.655 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.448 ' OH ' ' CE ' ' A' ' 34' ' ' LYS . 98.1 m-85 -112.2 174.66 5.77 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.289 -0.882 . . . . 0.0 110.616 -179.477 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.401 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 1.1 m170 -92.64 -172.35 3.02 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.842 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.93 HG22 ' CE1' ' A' ' 93' ' ' HIS . 35.2 mm -83.74 -41.62 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.928 178.828 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -89.13 -24.29 22.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.01 -1.056 . . . . 0.0 111.384 179.164 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 60.8 m -75.8 -41.44 52.81 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.638 -1.289 . . . . 0.0 110.198 -179.946 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -36.24 67.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.399 -0.92 . . . . 0.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.446 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 11.2 m-85 -80.89 -31.69 35.13 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 119.024 -1.07 . . . . 0.0 109.737 179.089 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -78.79 -33.42 46.28 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.032 -1.042 . . . . 0.0 109.677 178.153 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -72.95 -33.39 65.88 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.028 -1.045 . . . . 0.0 109.979 179.224 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.469 HD11 ' O ' ' A' ' 68' ' ' LYS . 2.9 tp -75.24 -40.15 59.25 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.033 -1.042 . . . . 0.0 109.443 179.291 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -73.5 -30.28 63.03 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.219 -0.925 . . . . 0.0 110.324 178.925 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.75 -30.47 14.24 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.036 -1.04 . . . . 0.0 111.003 179.918 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 59' ' ' LYS . . . -121.95 106.57 11.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.907 -1.121 . . . . 0.0 110.429 -179.567 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.5 ttp-105 -119.84 102.74 8.79 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.247 -0.908 . . . . 0.0 110.241 179.773 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.15 -35.97 15.95 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.145 -0.972 . . . . 0.0 110.424 179.66 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.1 p -131.38 -168.04 1.95 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.102 -0.999 . . . . 0.0 109.625 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -86.6 98.46 11.1 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.983 -1.073 . . . . 0.0 109.722 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.469 ' O ' HD11 ' A' ' 60' ' ' LEU . 17.1 ttpt -143.96 113.72 7.16 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.289 -0.882 . . . . 0.0 110.108 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.5 tptm -140.34 138.33 34.79 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.214 -0.929 . . . . 0.0 110.556 -179.916 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.5 mt -112.51 113.83 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.292 -0.88 . . . . 0.0 109.66 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.414 ' HA ' ' CG2' ' A' ' 94' ' ' ILE . 12.7 mt-10 -110.48 155.04 22.79 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.185 -0.947 . . . . 0.0 110.391 -179.777 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.563 ' N ' HG21 ' A' ' 94' ' ' ILE . 0.8 OUTLIER 50.95 -175.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.06 -1.025 . . . . 0.0 110.897 -179.983 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.673 HD23 ' HG3' ' A' ' 87' ' ' LYS . 15.2 tp -125.61 37.92 4.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.281 -0.887 . . . . 0.0 110.575 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.614 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.6 OUTLIER -145.64 39.19 1.15 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.189 -0.945 . . . . 0.0 110.306 179.661 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.504 ' HB2' HD23 ' A' ' 76' ' ' LEU . 13.9 mt-10 -109.75 -58.61 2.03 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.204 -0.935 . . . . 0.0 109.581 179.452 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.631 HD23 ' N ' ' A' ' 76' ' ' LEU . 1.3 pt? -145.28 62.69 1.29 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.235 -0.916 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.726 ' HB2' HG22 ' A' ' 8' ' ' VAL . 0.7 OUTLIER -145.86 141.0 27.45 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.902 -1.124 . . . . 0.0 111.062 179.394 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.89 69.24 2.45 Favored Glycine 0 N--CA 1.496 2.675 0 N-CA-C 108.943 -1.663 . . . . 0.0 108.943 179.227 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.614 ' CE2' HG22 ' A' ' 74' ' ' THR . 61.7 p-90 -89.08 -23.49 22.51 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.248 -1.148 . . . . 0.0 111.783 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -52.12 -33.55 40.41 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.581 -1.324 . . . . 0.0 110.692 179.829 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.73 -38.43 28.77 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.953 -1.092 . . . . 0.0 109.817 179.173 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.403 ' CD2' ' CD1' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -50.88 177.58 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.139 -0.976 . . . . 0.0 110.686 -179.991 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -102.75 160.45 14.58 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.122 -0.986 . . . . 0.0 110.355 179.823 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -60.94 -43.5 98.6 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.259 -0.9 . . . . 0.0 110.177 -179.819 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -61.27 -50.57 72.49 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.27 -0.893 . . . . 0.0 109.56 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 1.2 mp0 -62.92 -41.04 99.34 Favored 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.157 178.975 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.673 ' HG3' HD23 ' A' ' 73' ' ' LEU . 1.3 ttpm? -60.09 -38.46 82.98 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.35 -0.844 . . . . 0.0 110.005 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.84 -39.14 93.09 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.227 -0.92 . . . . 0.0 110.065 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -39.82 87.69 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.103 -0.998 . . . . 0.0 110.006 179.791 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 87' ' ' LYS . 13.6 mt -66.13 -39.73 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.197 -0.939 . . . . 0.0 109.395 179.45 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.49 -37.9 79.46 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.171 -0.956 . . . . 0.0 109.955 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -58.29 -39.86 80.41 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.194 -0.942 . . . . 0.0 109.814 179.454 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.93 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.84 -50.83 72.52 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.178 -0.951 . . . . 0.0 110.076 179.813 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.563 HG21 ' N ' ' A' ' 72' ' ' ASP . 4.1 mt -58.88 -38.4 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.18 -0.95 . . . . 0.0 110.015 179.851 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.65 -38.89 86.32 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.164 -0.96 . . . . 0.0 109.681 179.276 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -59.81 -46.2 89.98 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.168 -0.958 . . . . 0.0 109.596 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.4 mp -57.21 -34.26 68.36 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.116 -0.99 . . . . 0.0 110.381 179.589 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.2 m -97.93 51.41 1.04 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.03 -1.044 . . . . 0.0 110.095 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.1 p -142.28 120.33 12.11 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.945 . . . . 0.0 110.1 179.926 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? 53.16 72.1 0.45 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.052 -1.03 . . . . 0.0 110.766 -179.863 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -117.35 -57.08 2.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.126 -0.984 . . . . 0.0 110.286 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -115.67 155.86 26.95 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.181 -0.949 . . . . 0.0 110.174 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -82.26 153.34 32.02 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.891 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.06 96.45 49.33 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.246 -1.149 . . . . 0.0 110.209 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.27 74.65 2.5 Favored 'Trans proline' 0 C--N 1.316 -1.135 0 O-C-N 123.421 1.221 . . . . 0.0 110.376 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -141.89 145.93 35.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.199 -0.938 . . . . 0.0 110.182 -179.985 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.92 -63.92 1.13 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.208 -0.933 . . . . 0.0 110.325 -179.964 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.97 40.93 1.67 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -129.45 127.79 41.61 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.159 -0.963 . . . . 0.0 110.157 179.978 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.9 147.69 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.133 -0.98 . . . . 0.0 110.227 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.9 m -135.67 143.05 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.153 -0.967 . . . . 0.0 110.244 179.936 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -117.59 116.38 26.97 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.164 -0.96 . . . . 0.0 110.266 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -132.12 118.6 19.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.187 -0.945 . . . . 0.0 110.23 179.974 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -119.72 117.42 28.2 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.208 -0.933 . . . . 0.0 110.214 -179.962 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 17.8 mt -125.67 138.18 53.89 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.28 -0.887 . . . . 0.0 110.17 -179.986 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.3 m -121.91 140.86 51.9 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.298 -0.876 . . . . 0.0 110.232 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.232 -179.997 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 mtp . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.7 80.83 1.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.192 -0.942 . . . . 0.0 110.292 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -134.79 49.66 2.21 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.132 -0.98 . . . . 0.0 110.294 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -142.42 117.09 9.78 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.182 -0.948 . . . . 0.0 110.22 179.796 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -117.51 146.84 43.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.138 -0.976 . . . . 0.0 110.329 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.668 ' CD1' HD11 ' A' ' 70' ' ' ILE . 0.7 OUTLIER -140.28 136.82 33.68 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.317 -0.864 . . . . 0.0 109.88 -179.882 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.512 ' O ' HG23 ' A' ' 32' ' ' ILE . 4.1 m -151.74 160.85 43.44 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.198 -0.939 . . . . 0.0 110.056 178.942 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -101.41 120.9 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.996 -1.065 . . . . 0.0 110.638 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -114.24 146.85 39.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.207 -0.933 . . . . 0.0 109.445 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.575 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.2 OUTLIER -100.22 147.16 26.03 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.854 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.484 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -83.99 128.18 34.37 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.008 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -151.77 38.02 0.59 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.176 -0.952 . . . . 0.0 110.77 179.953 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.58 50.82 0.18 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.183 -0.948 . . . . 0.0 110.887 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.41 -147.88 16.92 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -133.42 149.17 51.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.27 -1.136 . . . . 0.0 110.333 -179.948 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.4 132.09 45.6 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.206 -0.934 . . . . 0.0 110.678 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.73 121.9 28.17 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 179.835 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.401 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . 34.8 t -62.78 137.54 58.29 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.324 -1.103 . . . . 0.0 110.298 -179.334 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -88.48 152.84 21.61 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 177.596 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.71 33.18 18.11 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.862 -1.149 . . . . 0.0 109.824 -178.413 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 150.78 0.35 Allowed 'General case' 0 N--CA 1.517 2.893 0 O-C-N 120.827 -1.17 . . . . 0.0 109.373 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -93.96 67.58 3.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.155 -0.965 . . . . 0.0 109.773 179.793 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -149.86 -176.27 5.36 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.256 -0.902 . . . . 0.0 110.403 -179.366 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -132.67 150.9 52.09 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.952 -1.092 . . . . 0.0 109.881 -179.236 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.704 HG23 ' CG2' ' A' ' 29' ' ' VAL . 13.4 mt -104.21 98.29 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.361 -0.837 . . . . 0.0 109.167 179.517 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 49.0 t -85.19 157.61 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 O-C-N 121.305 -0.872 . . . . 0.0 110.514 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -51.3 123.56 9.88 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.261 -0.899 . . . . 0.0 110.725 -179.605 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.19 -18.15 10.38 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 119.937 -1.125 . . . . 0.0 111.363 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.704 ' CG2' HG23 ' A' ' 25' ' ' ILE . 4.4 m -98.9 135.02 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 CA-C-N 119.584 1.692 . . . . 0.0 110.367 -179.51 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.4 p -79.55 131.65 36.08 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.934 179.851 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.518 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.4 ptt-85 -132.81 149.71 52.24 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.278 -0.889 . . . . 0.0 110.091 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.512 HG23 ' O ' ' A' ' 7' ' ' CYS . 17.5 mt -106.25 130.8 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.151 -0.968 . . . . 0.0 109.841 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.435 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.46 138.43 14.25 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.406 -1.878 . . . . 0.0 108.406 179.225 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 9.0 ttpt -107.15 108.96 20.67 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.184 -1.186 . . . . 0.0 109.469 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.447 HG12 ' OD1' ' A' ' 46' ' ' ASP . 52.7 t -85.83 119.64 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.054 -1.029 . . . . 0.0 110.383 -179.755 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.425 HG21 ' HE3' ' A' ' 34' ' ' LYS . 60.9 t -121.41 112.04 33.04 Favored Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.24 -0.912 . . . . 0.0 109.873 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.84 134.33 21.59 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 O-C-N 123.141 1.074 . . . . 0.0 110.544 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -103.54 160.81 24.96 Favored Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.19 140.08 30.37 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.392 1.207 . . . . 0.0 110.358 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 55.3 100.49 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.1 -1.0 . . . . 0.0 110.591 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.403 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 89.9 p -111.66 105.29 13.78 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.189 -0.944 . . . . 0.0 110.492 179.944 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -102.23 -54.78 2.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.239 -0.913 . . . . 0.0 109.832 179.467 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.43 -41.13 12.26 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.21 -0.931 . . . . 0.0 109.976 179.367 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -122.35 -111.51 2.11 Favored Glycine 0 N--CA 1.493 2.488 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' GLY . . . . . 0.403 ' CA ' ' HB2' ' A' ' 41' ' ' SER . . . 143.12 -65.18 0.48 Allowed Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.961 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.447 ' OD1' HG12 ' A' ' 35' ' ' VAL . 1.2 t0 -114.94 133.23 56.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -1.165 . . . . 0.0 109.922 179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.6 mmt -117.3 144.41 44.9 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.182 -0.949 . . . . 0.0 110.523 -179.808 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -139.84 139.0 36.22 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.357 -0.839 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -111.04 130.91 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.192 -0.942 . . . . 0.0 109.6 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.559 ' O ' HD11 ' A' ' 25' ' ' ILE . 7.8 m95 -89.91 113.54 25.18 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.19 -0.944 . . . . 0.0 109.627 179.768 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.47 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -137.5 168.3 19.93 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.787 -1.165 . . . . 0.0 111.4 178.977 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 60.4 m80 -71.89 158.15 36.56 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.57 -0.706 . . . . 0.0 109.769 -179.151 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.492 HG22 ' CD2' ' A' ' 93' ' ' HIS . 51.1 mt -61.67 -44.58 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.264 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -31.4 65.57 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.253 -0.905 . . . . 0.0 110.552 179.461 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.4 m -70.76 -41.08 72.22 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.024 -1.048 . . . . 0.0 109.749 179.852 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.9 tpt -76.31 -40.58 51.14 Favored 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.964 178.765 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CD1' ' CG2' ' A' ' 53' ' ' ILE . 7.5 m-85 -64.68 -33.27 75.56 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.543 178.507 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -58.15 -39.6 79.22 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.986 -1.071 . . . . 0.0 109.833 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.5 tttp -63.61 -40.08 95.99 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.585 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.95 -42.67 85.45 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.095 -1.003 . . . . 0.0 109.251 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.0 -35.46 73.28 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.234 -0.916 . . . . 0.0 109.327 178.501 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -105.78 31.53 4.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.18 169.23 9.01 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.902 -1.124 . . . . 0.0 110.013 179.958 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.48 155.7 17.69 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.176 -0.952 . . . . 0.0 110.241 -179.968 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -33.84 70.04 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.218 -0.926 . . . . 0.0 110.578 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.5 p -52.53 -35.17 52.8 Favored 'General case' 0 N--CA 1.514 2.738 0 O-C-N 120.878 -1.139 . . . . 0.0 110.781 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 29.7 p -114.49 107.65 15.81 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.053 -1.029 . . . . 0.0 110.385 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -121.23 144.91 48.35 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.202 -0.936 . . . . 0.0 110.011 179.742 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 150.1 43.93 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.183 -0.948 . . . . 0.0 110.803 -179.84 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.709 ' HA ' HD21 ' A' ' 76' ' ' LEU . 77.9 mt 52.87 99.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.187 -0.946 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.2 139.6 48.64 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 108.865 178.688 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 55.42 -163.74 0.14 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.948 -1.095 . . . . 0.0 109.712 -179.249 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.552 ' C ' HD23 ' A' ' 73' ' ' LEU . 10.6 tt -106.49 -51.13 3.0 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.925 -1.109 . . . . 0.0 110.685 -179.845 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.402 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -80.73 77.43 7.58 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.097 -1.002 . . . . 0.0 110.167 -179.829 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.757 ' HB3' HD23 ' A' ' 76' ' ' LEU . 29.2 tt0 -138.65 -58.61 0.62 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.131 -0.98 . . . . 0.0 110.499 179.749 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.757 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.5 pt? -147.62 60.05 1.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.972 -1.08 . . . . 0.0 110.805 179.208 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.6 ' HB2' HG22 ' A' ' 8' ' ' VAL . 10.0 pt-20 -145.2 140.71 28.09 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.81 -1.181 . . . . 0.0 110.71 178.42 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.27 69.33 1.67 Allowed Glycine 0 N--CA 1.497 2.709 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.402 ' CE2' HG22 ' A' ' 74' ' ' THR . 60.1 p-90 -91.47 -38.41 12.57 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.172 -1.193 . . . . 0.0 110.557 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -53.86 -28.3 35.21 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.08 -1.013 . . . . 0.0 111.261 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -91.19 -36.22 14.07 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.872 -1.143 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.575 HD13 ' CD2' ' A' ' 10' ' ' TYR . 94.5 mt -69.08 -173.93 0.56 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.989 -1.07 . . . . 0.0 109.848 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.34 161.45 30.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.178 -0.952 . . . . 0.0 110.575 -179.562 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -77.6 -36.35 51.97 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.24 -0.912 . . . . 0.0 110.278 179.599 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -52.25 -37.53 55.55 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.989 -1.07 . . . . 0.0 110.126 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.425 ' HG3' ' CE2' ' A' ' 10' ' ' TYR . 0.7 OUTLIER -57.98 -40.57 80.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.205 -0.934 . . . . 0.0 109.311 178.812 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -37.53 64.9 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.325 -0.859 . . . . 0.0 109.984 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -69.0 -41.42 77.84 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.257 -0.902 . . . . 0.0 109.27 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -64.95 -36.32 84.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.229 -0.919 . . . . 0.0 110.022 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.94 -41.1 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 67.8 p -60.15 -38.77 84.15 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.112 -0.992 . . . . 0.0 110.105 179.986 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -58.42 -38.51 77.57 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.214 -0.929 . . . . 0.0 110.061 179.694 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' HIS . . . . . 0.492 ' CD2' HG22 ' A' ' 53' ' ' ILE . 4.8 m80 -65.18 -53.52 43.54 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.552 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.77 -34.73 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.25 179.004 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.3 -39.38 71.49 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.148 -0.97 . . . . 0.0 109.55 179.111 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.54 -37.85 85.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 109.663 179.244 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.6 tp -78.85 -29.74 44.76 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.154 -0.966 . . . . 0.0 110.718 179.461 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -103.6 39.39 1.61 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.871 -1.143 . . . . 0.0 110.49 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.3 m -155.07 55.66 0.65 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.146 -0.971 . . . . 0.0 110.608 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -130.73 130.82 44.28 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.125 -0.985 . . . . 0.0 110.277 179.912 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -133.86 40.37 3.09 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.295 -0.878 . . . . 0.0 110.201 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.78 124.57 18.43 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.235 -0.915 . . . . 0.0 110.189 -179.96 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 99.88 -54.0 0.95 Allowed Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.7 m -123.04 93.4 48.32 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.189 -1.183 . . . . 0.0 110.122 -179.975 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.92 143.42 36.64 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 O-C-N 123.431 1.227 . . . . 0.0 110.455 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -143.0 90.46 2.2 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.175 -0.953 . . . . 0.0 110.242 179.988 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.7 tptt -124.14 -61.29 1.37 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.156 -0.965 . . . . 0.0 110.186 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -149.8 101.13 3.03 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.13 -0.981 . . . . 0.0 110.57 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -134.35 154.17 51.49 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.188 -0.945 . . . . 0.0 110.091 179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 7.9 p -130.17 145.73 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.136 -0.977 . . . . 0.0 110.394 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.6 t -140.61 144.12 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.094 -1.004 . . . . 0.0 110.042 -179.869 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -108.35 103.76 12.99 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.268 -0.895 . . . . 0.0 109.752 179.558 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -116.17 142.55 46.67 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.242 -0.911 . . . . 0.0 110.542 -179.529 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 24.3 mtpt -110.28 151.86 26.86 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.167 -0.958 . . . . 0.0 109.902 179.683 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.9 tp -105.37 110.15 22.39 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.24 -0.912 . . . . 0.0 110.323 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 6.9 t -140.87 150.68 43.54 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.238 -0.914 . . . . 0.0 110.15 179.897 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.0 p . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.227 -179.962 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 110.251 -0.278 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.79 126.37 52.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.184 -0.948 . . . . 0.0 110.145 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.543 ' HB3' HD11 ' A' ' 76' ' ' LEU . 1.7 m-85 -120.77 142.8 49.22 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.27 -0.894 . . . . 0.0 110.186 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.455 ' O ' HG23 ' A' ' 32' ' ' ILE . 84.4 m -133.96 158.92 42.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.2 -0.937 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.73 ' CG2' HD23 ' A' ' 76' ' ' LEU . 58.4 t -116.81 125.76 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.149 -0.969 . . . . 0.0 110.05 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -142.61 158.46 43.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.147 -0.971 . . . . 0.0 110.668 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.446 ' OH ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -106.84 148.51 28.45 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.462 -0.774 . . . . 0.0 110.026 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.71 135.89 57.79 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.218 -0.927 . . . . 0.0 109.809 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -114.32 -56.44 2.39 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 110.291 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -153.36 130.97 11.48 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.181 -0.949 . . . . 0.0 110.655 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.85 158.19 23.43 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.893 HG22 HG22 ' A' ' 26' ' ' VAL . 77.0 p -118.14 136.98 53.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.208 -1.172 . . . . 0.0 110.063 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -129.07 132.17 47.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.126 -0.984 . . . . 0.0 110.483 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.01 111.27 3.96 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.9 t -65.15 157.76 27.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.26 -1.141 . . . . 0.0 109.182 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -87.63 155.54 19.9 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.584 -0.697 . . . . 0.0 110.197 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.54 28.26 4.64 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.266 -0.896 . . . . 0.0 111.914 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 p -172.1 163.82 6.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.787 -1.195 . . . . 0.0 111.295 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.74 53.64 0.86 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -136.03 -174.63 3.72 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.481 -0.762 . . . . 0.0 110.355 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.6 pttt -139.05 156.44 47.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.636 HG21 ' NH1' ' A' ' 31' ' ' ARG . 41.3 mt -95.52 105.32 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.368 -0.833 . . . . 0.0 109.564 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.893 HG22 HG22 ' A' ' 15' ' ' THR . 57.4 t -108.57 162.75 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.241 -0.912 . . . . 0.0 109.931 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -41.07 126.22 2.55 Favored 'General case' 0 N--CA 1.52 3.057 0 O-C-N 121.668 -0.645 . . . . 0.0 111.548 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 110.3 -3.84 29.78 Favored Glycine 0 N--CA 1.492 2.392 0 C-N-CA 120.111 -1.042 . . . . 0.0 111.125 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.1 t -110.48 134.12 53.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-N 119.564 1.682 . . . . 0.0 109.871 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.8 t -89.88 132.54 35.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.246 -0.909 . . . . 0.0 108.861 178.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.636 ' NH1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -130.86 151.99 50.68 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.145 -0.972 . . . . 0.0 111.308 -178.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 7' ' ' CYS . 38.5 mt -103.71 139.59 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.419 -0.801 . . . . 0.0 109.078 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.17 128.1 9.41 Favored Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 29.7 tttt -110.41 114.96 28.81 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.277 -1.131 . . . . 0.0 109.738 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.528 HG22 ' HB3' ' A' ' 48' ' ' LYS . 61.7 t -98.72 107.76 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.199 -0.938 . . . . 0.0 110.419 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.405 HG23 ' HD2' ' A' ' 37' ' ' PRO . 10.3 p -124.69 143.14 42.64 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.268 -0.895 . . . . 0.0 109.934 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.405 ' HD2' HG23 ' A' ' 36' ' ' VAL . 50.1 Cg_endo -76.11 127.56 10.02 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.261 1.137 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m120 . . . . . 0 N--CA 1.499 2.012 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 179.752 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.454 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -116.46 137.28 52.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.186 -1.185 . . . . 0.0 110.166 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.3 ttt -116.97 152.28 34.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.234 -0.917 . . . . 0.0 110.244 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HB3' HG22 ' A' ' 35' ' ' VAL . 13.2 pttt -125.03 145.16 50.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.266 -0.896 . . . . 0.0 110.617 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.28 156.62 43.7 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.0 109.652 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -101.55 142.3 33.13 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.15 -0.968 . . . . 0.0 110.127 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -121.3 174.14 6.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.314 -0.866 . . . . 0.0 110.718 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 2.8 m80 -93.65 -173.82 3.29 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.981 HG22 ' CE1' ' A' ' 93' ' ' HIS . 45.5 mm -83.27 -33.73 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.32 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -90.57 -33.89 15.71 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.771 -1.206 . . . . 0.0 110.686 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 73.2 m -63.24 -52.31 62.67 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.927 -1.108 . . . . 0.0 110.307 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.1 88.96 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.275 -0.891 . . . . 0.0 110.375 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.444 ' CE1' HG13 ' A' ' 94' ' ' ILE . 10.4 m-85 -75.17 -30.35 60.7 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.02 -1.072 . . . . 0.0 109.751 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -68.23 -36.18 79.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.981 -1.074 . . . . 0.0 109.564 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 41.2 tttm -59.97 -40.05 87.74 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.996 . . . . 0.0 109.761 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -59.89 -44.91 93.97 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.738 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -58.56 -35.1 71.84 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.212 -0.93 . . . . 0.0 110.436 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 ttt-85 -89.71 -29.2 18.91 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.18 -0.95 . . . . 0.0 111.01 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.509 2.512 0 O-C-N 120.826 -1.171 . . . . 0.0 110.186 -179.807 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.9 mtpt . . . . . 0 N--CA 1.493 1.72 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.4 mt 54.36 98.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.116 -0.99 . . . . 0.0 110.562 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -110.29 141.77 42.84 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.139 -0.976 . . . . 0.0 110.02 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -165.56 0.08 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.056 -1.027 . . . . 0.0 110.516 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.559 HD21 ' HG3' ' A' ' 87' ' ' LYS . 15.9 tp -114.72 37.64 3.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.139 -0.975 . . . . 0.0 110.508 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -152.96 36.74 0.49 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.067 -1.021 . . . . 0.0 110.8 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.653 ' O ' HD12 ' A' ' 76' ' ' LEU . 48.1 mm-40 -125.35 38.81 4.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.119 -0.988 . . . . 0.0 109.776 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.73 HD23 ' CG2' ' A' ' 8' ' ' VAL . 1.0 OUTLIER -147.82 153.67 39.48 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.213 -0.93 . . . . 0.0 110.109 -179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -89.95 97.67 11.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.116 -0.99 . . . . 0.0 110.065 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.19 -35.25 0.84 Allowed Glycine 0 N--CA 1.495 2.63 0 C-N-CA 119.724 -1.227 . . . . 0.0 110.963 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.448 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 27.2 p-90 -52.09 -30.66 27.07 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.006 1.403 . . . . 0.0 111.062 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.448 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.6 tm-20 -60.0 -42.98 95.46 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 120.907 -1.121 . . . . 0.0 109.684 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.31 -39.46 90.58 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.172 -0.955 . . . . 0.0 109.816 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.6 mp -49.93 173.72 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.855 0 O-C-N 121.17 -0.956 . . . . 0.0 110.759 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -107.13 161.85 14.39 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.178 -0.951 . . . . 0.0 110.388 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.19 -43.9 74.82 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.132 -0.98 . . . . 0.0 110.481 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -62.43 -51.15 68.67 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.262 -0.899 . . . . 0.0 109.43 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.446 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 0.6 OUTLIER -62.19 -38.88 90.8 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.297 -0.877 . . . . 0.0 109.331 179.031 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.559 ' HG3' HD21 ' A' ' 73' ' ' LEU . 24.3 tttt -59.43 -39.19 82.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.233 -0.917 . . . . 0.0 109.775 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -59.99 -40.0 87.64 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.715 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.12 -38.94 92.86 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.219 -0.926 . . . . 0.0 110.019 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.49 ' CD1' HD12 ' A' ' 53' ' ' ILE . 45.9 mm -68.45 -41.51 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.152 -0.967 . . . . 0.0 109.026 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.543 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -60.55 -38.17 83.62 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.23 -0.919 . . . . 0.0 109.935 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -58.93 -40.23 83.97 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.149 -0.97 . . . . 0.0 109.991 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.981 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.3 m-70 -59.93 -47.61 85.08 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.206 -0.934 . . . . 0.0 109.933 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' CE1' ' A' ' 57' ' ' PHE . 19.4 mt -63.67 -39.25 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.202 -0.936 . . . . 0.0 109.61 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.03 95.83 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.216 -0.927 . . . . 0.0 109.438 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.24 -40.44 67.71 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.229 -0.919 . . . . 0.0 109.088 178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.425 HD22 ' HD1' ' A' ' 57' ' ' PHE . 50.1 tp -68.45 -33.12 73.62 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.196 -0.94 . . . . 0.0 110.228 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.7 t -93.96 -58.81 2.13 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.945 -1.097 . . . . 0.0 110.007 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.501 2.115 0 O-C-N 121.04 -1.037 . . . . 0.0 110.89 179.804 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 . . . . . 0 N--CA 1.493 1.704 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -119.82 138.44 53.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.264 -0.898 . . . . 0.0 110.205 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.642 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.9 m-85 -118.21 150.06 40.04 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.219 -0.925 . . . . 0.0 110.284 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.9 m -134.15 156.39 48.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.262 -0.899 . . . . 0.0 110.032 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 52.6 t -109.82 135.54 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.118 -0.989 . . . . 0.0 110.028 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -148.35 153.58 38.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.185 -0.947 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -110.87 148.44 32.42 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.41 -0.807 . . . . 0.0 109.549 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.29 130.92 41.91 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.514 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -138.05 -65.68 0.51 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.171 -0.956 . . . . 0.0 110.432 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -116.98 110.87 18.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.214 -0.929 . . . . 0.0 110.318 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.18 142.34 10.49 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 25' ' ' ILE . 5.4 m -116.26 135.88 53.5 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.205 -1.174 . . . . 0.0 110.048 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.28 144.51 31.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.182 -0.949 . . . . 0.0 110.51 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -68.7 156.34 53.35 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -91.83 143.86 26.08 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.211 -1.17 . . . . 0.0 108.726 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CB ' ' CE2' ' A' ' 51' ' ' TYR . 4.3 mmtt -52.91 147.32 9.32 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 120.86 -1.15 . . . . 0.0 110.311 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt 53.28 62.01 2.87 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.137 -0.977 . . . . 0.0 110.242 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.3 t -172.49 148.7 2.04 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.917 -1.114 . . . . 0.0 111.913 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -107.45 45.99 0.97 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -132.51 -171.84 2.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.591 -0.693 . . . . 0.0 109.956 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -135.3 153.09 51.99 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.026 -1.047 . . . . 0.0 110.535 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.721 HG23 ' CG2' ' A' ' 29' ' ' VAL . 72.0 mt -107.01 112.88 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.371 -0.83 . . . . 0.0 109.6 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.493 HG22 ' HG2' ' A' ' 27' ' ' LYS . 13.4 p -111.11 161.19 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.195 -0.941 . . . . 0.0 110.609 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.493 ' HG2' HG22 ' A' ' 26' ' ' VAL . 1.6 ptpp? -46.22 120.24 2.7 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 121.437 -0.79 . . . . 0.0 111.282 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 125.22 -22.0 6.37 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.999 -1.096 . . . . 0.0 111.004 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.721 ' CG2' HG23 ' A' ' 25' ' ' ILE . 8.9 m -100.69 138.21 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 CA-C-N 119.342 1.571 . . . . 0.0 110.52 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 42.4 t -82.66 141.96 32.08 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.233 -0.917 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.45 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 3.5 ptt85 -138.19 150.41 46.73 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.325 -0.859 . . . . 0.0 110.174 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.1 mt -105.62 144.25 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.293 -0.879 . . . . 0.0 109.98 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.89 132.13 10.99 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.424 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 27.5 ttpt -116.36 115.33 25.69 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.095 -1.238 . . . . 0.0 110.066 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.446 HG22 ' HG3' ' A' ' 48' ' ' LYS . 59.0 t -102.12 111.13 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.158 -0.964 . . . . 0.0 110.436 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.8 p -122.51 143.4 39.63 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.195 -0.94 . . . . 0.0 110.257 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -78.38 150.03 24.99 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 O-C-N 123.123 1.065 . . . . 0.0 110.634 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 . . . . . 0 N--CA 1.5 2.044 0 O-C-N 121.306 -0.872 . . . . 0.0 110.108 179.652 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 2.734 0 N-CA-C 109.824 -1.311 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -114.57 152.71 31.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.192 -1.181 . . . . 0.0 110.037 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.0 mmt -112.56 124.97 53.73 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.276 -0.89 . . . . 0.0 110.35 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.446 ' HG3' HG22 ' A' ' 35' ' ' VAL . 21.0 ttmt -117.7 122.27 43.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.213 -0.929 . . . . 0.0 110.147 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -127.44 152.21 47.83 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.194 -0.942 . . . . 0.0 109.85 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 72.1 m95 -98.83 141.93 30.99 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.234 -0.916 . . . . 0.0 110.081 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CE2' ' CB ' ' A' ' 19' ' ' LYS . 96.0 m-85 -120.73 174.25 6.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.304 -0.873 . . . . 0.0 110.465 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -95.24 -173.12 2.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.949 HG22 ' CE1' ' A' ' 93' ' ' HIS . 40.9 mm -87.16 -37.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.051 -1.031 . . . . 0.0 109.263 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -88.99 -27.95 20.54 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.887 -1.133 . . . . 0.0 110.821 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 65.7 m -71.58 -49.15 43.14 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.966 -1.084 . . . . 0.0 109.911 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.35 -37.34 83.09 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.36 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.448 ' CE1' HG13 ' A' ' 94' ' ' ILE . 5.9 m-85 -74.33 -32.8 62.96 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 118.952 -1.099 . . . . 0.0 109.588 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -63.37 -36.74 84.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.49 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 24.9 mtpp -59.9 -40.02 87.35 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.135 -0.978 . . . . 0.0 109.779 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -58.11 -45.28 87.52 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.179 -0.95 . . . . 0.0 109.262 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -59.56 -36.07 75.47 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 119.574 -0.851 . . . . 0.0 109.407 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -108.61 32.3 4.96 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.311 -0.868 . . . . 0.0 110.368 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.604 ' HB2' ' O ' ' A' ' 59' ' ' LYS . . . . . . . . 0 N--CA 1.497 1.884 0 O-C-N 120.909 -1.119 . . . . 0.0 110.22 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.1 mttt . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.568 HG23 HD11 ' A' ' 76' ' ' LEU . 77.2 mt 55.18 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.202 -0.936 . . . . 0.0 110.791 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -108.91 141.45 40.96 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.197 -0.94 . . . . 0.0 109.961 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 53.17 -173.06 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.987 -1.071 . . . . 0.0 110.677 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.677 HD22 ' OG1' ' A' ' 91' ' ' THR . 14.1 tp -98.39 -35.53 10.26 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.178 -0.951 . . . . 0.0 111.102 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -102.8 50.23 0.82 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.918 -1.114 . . . . 0.0 110.446 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -125.5 38.17 4.22 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.196 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 6' ' ' PHE . 48.4 mt -145.48 155.2 42.96 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.216 -0.927 . . . . 0.0 110.135 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -84.46 97.69 9.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.055 -1.028 . . . . 0.0 110.277 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.72 -37.32 0.62 Allowed Glycine 0 N--CA 1.497 2.736 0 C-N-CA 119.689 -1.243 . . . . 0.0 111.036 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.451 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 34.8 p-90 -55.22 -33.3 62.96 Favored 'General case' 0 N--CA 1.513 2.717 0 O-C-N 120.872 -1.369 . . . . 0.0 110.728 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.451 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.2 tt0 -54.18 -39.48 66.65 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.91 -1.119 . . . . 0.0 110.243 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -72.25 -36.43 69.07 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.212 -0.93 . . . . 0.0 110.02 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.43 HD23 ' CB ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -53.25 -179.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.793 0 O-C-N 121.104 -0.998 . . . . 0.0 110.343 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -106.76 161.07 14.99 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.12 -0.987 . . . . 0.0 110.33 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.41 -39.94 81.12 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.391 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -66.23 -42.3 88.83 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.585 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.43 ' CB ' HD23 ' A' ' 82' ' ' LEU . 75.8 mt-10 -66.73 -39.89 88.16 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.539 -0.864 . . . . 0.0 109.359 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.691 ' HA ' HD12 ' A' ' 90' ' ' ILE . 35.8 mtpt -60.54 -38.38 84.29 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.265 -0.897 . . . . 0.0 109.9 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.02 -40.36 84.74 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.879 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.44 -40.19 96.49 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 87' ' ' LYS . 12.0 mt -65.38 -40.79 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.235 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.677 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.9 OUTLIER -59.22 -38.76 80.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.177 -0.952 . . . . 0.0 109.958 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -39.94 80.52 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.283 -0.886 . . . . 0.0 109.897 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.949 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.5 m-70 -58.35 -47.39 83.93 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.135 -0.978 . . . . 0.0 109.846 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.448 HG13 ' CE1' ' A' ' 57' ' ' PHE . 26.0 mt -66.12 -38.23 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.241 -0.912 . . . . 0.0 109.511 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.43 81.1 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.127 -0.983 . . . . 0.0 109.386 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.46 -41.89 68.84 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.217 -0.927 . . . . 0.0 108.836 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.425 HD22 ' HD1' ' A' ' 57' ' ' PHE . 28.5 tp -71.0 -33.64 70.6 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.345 -0.847 . . . . 0.0 109.815 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 41.3 m -100.67 46.73 0.94 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.968 -1.082 . . . . 0.0 110.075 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.174 -0.954 . . . . 0.0 110.368 179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 . . . . . 0 N--CA 1.495 1.782 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.06 121.65 32.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.197 -0.939 . . . . 0.0 110.308 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.595 ' HD1' HG22 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -112.5 144.49 41.87 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.171 -0.955 . . . . 0.0 109.722 179.687 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.7 p -135.65 164.62 27.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.899 . . . . 0.0 110.177 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.708 HG13 HD12 ' A' ' 76' ' ' LEU . 34.1 m -125.26 140.77 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.173 -0.955 . . . . 0.0 110.955 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -146.78 97.4 2.9 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.146 -0.971 . . . . 0.0 110.163 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.62 ' CD2' HD13 ' A' ' 82' ' ' LEU . 7.3 m-85 -54.06 154.61 4.09 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.188 -0.945 . . . . 0.0 110.456 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.524 ' HB2' ' HE ' ' A' ' 31' ' ' ARG . . . -108.32 131.21 54.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.279 -0.888 . . . . 0.0 110.696 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -117.09 -57.81 2.12 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.242 -0.911 . . . . 0.0 109.912 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.7 mtm-85 -119.12 159.43 23.97 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.242 -0.912 . . . . 0.0 110.02 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.758 ' O ' HG23 ' A' ' 26' ' ' VAL . . . 81.64 162.42 29.59 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.53 HG23 ' HB ' ' A' ' 26' ' ' VAL . 17.5 m -133.86 144.21 48.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.144 -1.21 . . . . 0.0 110.322 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -135.77 143.42 45.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.737 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -74.37 123.51 7.78 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 11.0 t -62.35 130.61 46.05 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.272 -1.134 . . . . 0.0 109.412 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -61.89 147.8 45.54 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.173 -0.954 . . . . 0.0 109.209 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? 52.87 46.88 25.87 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.994 -1.066 . . . . 0.0 109.567 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.2 t -165.59 153.93 11.36 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.343 -0.848 . . . . 0.0 110.944 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -105.38 44.66 1.02 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -138.7 -175.03 4.0 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.464 -0.772 . . . . 0.0 109.978 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB3' HG22 ' A' ' 15' ' ' THR . 0.0 OUTLIER -133.56 157.24 46.18 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.203 -0.935 . . . . 0.0 110.06 -179.382 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.923 HG23 ' CG1' ' A' ' 29' ' ' VAL . 59.7 mt -112.61 123.28 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.395 -0.816 . . . . 0.0 109.956 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 14' ' ' GLY . 8.9 p -165.45 112.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.112 -0.992 . . . . 0.0 111.364 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.47 126.76 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.198 -0.939 . . . . 0.0 111.632 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.48 9.34 81.77 Favored Glycine 0 N--CA 1.496 2.652 0 O-C-N 121.077 -1.014 . . . . 0.0 111.808 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.923 ' CG1' HG23 ' A' ' 25' ' ' ILE . 95.1 t -126.66 135.59 63.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.708 1.754 . . . . 0.0 110.085 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.882 ' HB3' HD11 ' A' ' 53' ' ' ILE . 5.4 t -95.78 134.91 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.179 -0.95 . . . . 0.0 109.24 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.844 ' CG ' HG21 ' A' ' 25' ' ' ILE . 25.3 mtm180 -113.6 129.3 56.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.127 -0.983 . . . . 0.0 110.771 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.595 HG22 ' HD1' ' A' ' 6' ' ' PHE . 12.2 mt -103.81 128.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.215 -0.928 . . . . 0.0 108.515 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.9 130.52 10.27 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 21.0 tttm -107.03 113.53 27.06 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.334 -1.098 . . . . 0.0 109.393 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.491 HG22 ' HB3' ' A' ' 48' ' ' LYS . 48.7 t -96.72 112.76 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.142 -0.973 . . . . 0.0 110.538 -179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.1 t -120.77 111.03 34.69 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -73.39 127.35 11.77 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.205 1.108 . . . . 0.0 110.427 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 m120 . . . . . 0 N--CA 1.499 1.99 0 O-C-N 121.179 -0.95 . . . . 0.0 110.084 179.78 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.54 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -134.58 138.87 44.94 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.235 -1.156 . . . . 0.0 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.2 mtp -117.02 149.58 40.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.173 -0.954 . . . . 0.0 110.233 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HB3' HG22 ' A' ' 35' ' ' VAL . 24.0 pttt -129.46 144.91 51.45 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.32 -0.862 . . . . 0.0 110.534 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -122.76 148.06 45.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.147 -0.971 . . . . 0.0 109.581 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -93.99 151.07 19.8 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.104 -0.997 . . . . 0.0 110.133 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -135.03 173.22 11.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.279 -0.888 . . . . 0.0 110.414 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.436 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -96.03 -172.34 2.54 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.876 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.928 HG22 ' CE1' ' A' ' 93' ' ' HIS . 43.6 mm -84.38 -39.85 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 121.09 -1.006 . . . . 0.0 108.777 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -89.02 -25.68 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.922 -1.111 . . . . 0.0 111.081 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.7 m -75.95 -42.2 49.31 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.78 -1.2 . . . . 0.0 109.987 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -38.18 66.62 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.86 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.456 ' CE1' HG13 ' A' ' 94' ' ' ILE . 6.9 m-85 -73.6 -31.82 63.78 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 119.029 -1.068 . . . . 0.0 109.553 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -63.91 -38.24 90.37 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.052 -1.03 . . . . 0.0 109.337 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -41.17 97.7 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.515 179.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.99 -46.02 90.84 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.287 -0.883 . . . . 0.0 109.302 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -56.35 -33.73 65.95 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.765 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 24.7 mtp-105 -105.85 30.24 5.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.174 -0.953 . . . . 0.0 110.627 179.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.948 0 O-C-N 120.906 -1.121 . . . . 0.0 109.97 179.687 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 120.706 0.289 . . . . 0.0 110.256 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.3 mt 54.41 98.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.126 -0.984 . . . . 0.0 110.661 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -114.2 138.06 50.96 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.183 -0.948 . . . . 0.0 110.069 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.33 -166.01 0.07 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.061 -1.024 . . . . 0.0 110.596 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.749 HD22 ' OG1' ' A' ' 91' ' ' THR . 4.5 tp -115.63 39.54 2.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.176 -0.953 . . . . 0.0 110.374 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.599 HG22 ' CZ2' ' A' ' 79' ' ' TRP . 2.9 p -149.28 38.04 0.78 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.577 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.679 ' C ' HD22 ' A' ' 76' ' ' LEU . 3.2 mp0 -137.02 37.08 2.57 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.23 -0.919 . . . . 0.0 110.247 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.708 HD12 HG13 ' A' ' 8' ' ' VAL . 4.2 mm? -122.09 152.25 40.04 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.113 -0.992 . . . . 0.0 109.906 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.35 106.76 0.8 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.312 -0.868 . . . . 0.0 111.359 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 65.81 59.31 7.73 Favored Glycine 0 N--CA 1.492 2.423 0 O-C-N 121.247 -0.908 . . . . 0.0 111.161 178.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.599 ' CZ2' HG22 ' A' ' 74' ' ' THR . 34.9 p-90 -88.94 -38.19 14.67 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.967 -1.314 . . . . 0.0 109.952 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.474 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 8.5 tm-20 -69.2 -40.74 77.87 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.164 -0.96 . . . . 0.0 109.082 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.24 -28.02 50.36 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.199 -0.938 . . . . 0.0 111.144 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.62 HD13 ' CD2' ' A' ' 10' ' ' TYR . 95.6 mt -69.81 -175.06 0.83 Allowed 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.624 -1.297 . . . . 0.0 109.762 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -62.76 155.25 27.18 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.168 -0.957 . . . . 0.0 110.06 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -87.88 -41.07 13.46 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.241 -0.912 . . . . 0.0 110.192 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -65.66 -43.99 87.7 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.28 -0.887 . . . . 0.0 109.56 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 47.8 mt-10 -64.63 -39.47 93.76 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.332 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.49 ' HG3' HD21 ' A' ' 73' ' ' LEU . 12.7 tptt -58.52 -39.16 79.34 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.257 -0.902 . . . . 0.0 109.76 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.7 -37.93 74.33 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.242 -0.911 . . . . 0.0 109.969 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -59.24 -39.22 82.08 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.232 -0.917 . . . . 0.0 110.062 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 70.2 mt -64.53 -41.05 91.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 O-C-N 121.169 -0.957 . . . . 0.0 109.058 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.749 ' OG1' HD22 ' A' ' 73' ' ' LEU . 2.0 m -57.08 -38.45 73.34 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.179 -0.95 . . . . 0.0 109.966 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.11 -40.35 80.99 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.223 -0.923 . . . . 0.0 109.8 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.928 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.1 m-70 -60.39 -50.59 72.98 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.163 -0.961 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.456 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.0 mt -62.5 -39.44 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 109.471 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.67 -41.31 96.18 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.218 -0.926 . . . . 0.0 109.272 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.53 -40.99 69.71 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.028 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.9 tp -69.64 -33.85 73.2 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.282 -0.886 . . . . 0.0 110.073 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 18.2 t -96.44 -65.5 0.96 Allowed 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.1 t . . . . . 0 N--CA 1.501 2.081 0 O-C-N 121.079 -1.013 . . . . 0.0 110.792 -179.971 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.634 ' HA ' HG12 ' A' ' 36' ' ' VAL . 2.7 tt0 . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 120.898 0.38 . . . . 0.0 110.814 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -128.13 137.48 52.13 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.134 -0.978 . . . . 0.0 110.271 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.697 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.5 m-85 -115.98 137.65 51.92 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.136 -0.978 . . . . 0.0 110.162 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -122.25 164.93 17.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.25 -0.906 . . . . 0.0 109.308 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.544 HG12 HG23 ' A' ' 32' ' ' ILE . 32.7 m -134.97 134.3 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.926 -1.109 . . . . 0.0 110.815 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -139.93 147.63 40.81 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.211 -0.93 . . . . 0.0 109.876 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.569 ' HD2' HD22 ' A' ' 82' ' ' LEU . 1.7 m-85 -101.44 148.03 25.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.239 -0.913 . . . . 0.0 109.985 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.642 ' HB2' ' HD2' ' A' ' 31' ' ' ARG . . . -108.09 144.87 34.87 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.289 -0.882 . . . . 0.0 110.557 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -115.17 -56.4 2.37 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.224 -0.923 . . . . 0.0 110.122 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 mtt85 -141.39 72.95 1.4 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.565 ' O ' HG22 ' A' ' 26' ' ' VAL . . . -141.48 -176.2 15.61 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.459 ' HA ' HG22 ' A' ' 26' ' ' VAL . 34.9 m -140.22 116.16 10.35 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.154 -1.204 . . . . 0.0 110.235 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.19 133.3 24.36 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.163 -0.96 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -76.62 123.33 6.66 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.2 t -61.4 127.78 33.14 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.266 -1.138 . . . . 0.0 109.483 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -61.51 147.94 43.69 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.188 -0.945 . . . . 0.0 109.201 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 54.21 44.24 29.4 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.872 -1.142 . . . . 0.0 109.468 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.4 t -165.87 149.65 7.92 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.374 -0.829 . . . . 0.0 110.692 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 tttt -101.09 51.27 0.85 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 0.0 108.678 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.16 -174.99 4.44 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.453 -0.78 . . . . 0.0 110.339 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -133.67 161.05 35.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.184 -0.947 . . . . 0.0 109.759 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.822 HG23 ' CG1' ' A' ' 29' ' ' VAL . 51.7 mt -111.28 110.86 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.408 -0.808 . . . . 0.0 109.775 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 14' ' ' GLY . 57.5 t -141.04 103.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.134 -0.978 . . . . 0.0 111.455 -179.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.8 tttp 59.91 142.4 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.204 -0.935 . . . . 0.0 112.171 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.94 12.64 65.31 Favored Glycine 0 N--CA 1.497 2.754 0 O-C-N 121.088 -1.008 . . . . 0.0 111.841 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.822 ' CG1' HG23 ' A' ' 25' ' ' ILE . 84.0 t -128.77 136.65 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 CA-C-N 119.786 1.793 . . . . 0.0 110.486 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.886 ' HB3' HD11 ' A' ' 53' ' ' ILE . 3.0 t -94.57 131.55 40.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.284 -0.885 . . . . 0.0 108.788 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 11' ' ' ALA . 8.7 mtp180 -106.52 129.31 54.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.149 -0.969 . . . . 0.0 110.719 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.544 HG23 HG12 ' A' ' 8' ' ' VAL . 12.2 mt -104.31 127.11 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.91 126.97 9.07 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.422 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.7 ttpm? -103.44 107.83 18.83 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.365 -1.079 . . . . 0.0 109.331 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -102.03 107.86 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.161 -0.962 . . . . 0.0 110.605 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.634 HG12 ' HA ' ' A' ' 4' ' ' GLN . 34.4 m -123.57 146.22 49.4 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.282 -0.886 . . . . 0.0 109.778 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -76.04 135.62 17.42 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.224 1.118 . . . . 0.0 110.353 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 . . . . . 0 N--CA 1.5 2.036 0 O-C-N 121.182 -0.949 . . . . 0.0 109.886 179.7 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.473 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -134.32 142.21 47.18 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.239 -1.153 . . . . 0.0 110.039 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 34.8 mtp -117.71 137.09 52.92 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.117 -0.989 . . . . 0.0 110.618 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -131.56 129.11 40.56 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.218 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -132.84 155.01 49.76 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.206 -0.934 . . . . 0.0 109.888 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -98.49 163.37 12.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.115 -0.99 . . . . 0.0 110.006 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -145.71 172.37 13.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.227 -0.92 . . . . 0.0 110.596 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 -172.27 2.68 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.941 HG22 ' CE1' ' A' ' 93' ' ' HIS . 45.2 mm -86.72 -40.07 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.088 0 O-C-N 121.021 -1.049 . . . . 0.0 108.999 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -89.32 -24.47 22.0 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 120.864 -1.148 . . . . 0.0 111.012 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.4 m -75.17 -44.87 44.3 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.734 -1.229 . . . . 0.0 110.01 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -37.66 69.3 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.919 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.451 ' CE1' HG13 ' A' ' 94' ' ' ILE . 8.0 m-85 -74.08 -31.8 62.98 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.417 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.08 -37.75 88.44 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.002 -1.061 . . . . 0.0 109.531 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 7.0 tttp -58.71 -39.56 81.14 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.117 -0.989 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.3 mp -59.35 -43.33 92.81 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.264 -0.898 . . . . 0.0 109.299 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -36.16 74.95 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.282 -0.886 . . . . 0.0 109.513 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.3 mmt-85 -105.86 31.28 5.15 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.241 -0.912 . . . . 0.0 110.561 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 59' ' ' LYS . . . . . . . . 0 N--CA 1.496 1.854 0 O-C-N 120.907 -1.121 . . . . 0.0 110.109 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 22.9 mtmm . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 120.775 0.321 . . . . 0.0 110.218 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.691 HG23 HD11 ' A' ' 76' ' ' LEU . 76.4 mt 53.78 97.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.091 -1.006 . . . . 0.0 110.809 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -113.32 133.76 54.96 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.197 -0.939 . . . . 0.0 109.692 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 53.08 -170.54 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.958 -1.089 . . . . 0.0 110.333 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.492 HD21 ' HG2' ' A' ' 87' ' ' LYS . 27.5 tp -108.39 -58.58 1.98 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.081 -1.012 . . . . 0.0 110.051 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -33.74 70.16 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.166 -0.959 . . . . 0.0 110.544 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -49.07 -33.78 12.26 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 120.989 -1.07 . . . . 0.0 111.462 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 6' ' ' PHE . 54.7 mt -82.65 152.38 25.88 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.008 -1.058 . . . . 0.0 109.994 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -92.75 136.58 33.11 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.266 -0.896 . . . . 0.0 110.572 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 136.75 -47.49 0.96 Allowed Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.512 ' HA ' HD12 ' A' ' 82' ' ' LEU . 54.7 p-90 -50.48 -30.24 12.3 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.15 -1.206 . . . . 0.0 111.449 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.444 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 6.4 tm-20 -52.52 -28.85 22.29 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.883 -1.136 . . . . 0.0 111.28 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -113.06 29.31 8.08 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.95 -1.094 . . . . 0.0 111.788 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.569 HD22 ' HD2' ' A' ' 10' ' ' TYR . 33.3 mt -113.28 -165.85 1.03 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.854 -1.154 . . . . 0.0 109.799 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -100.78 162.21 13.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.049 -1.032 . . . . 0.0 110.068 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -79.12 -39.77 32.77 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.202 -0.936 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -69.19 -41.42 77.16 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.159 -0.963 . . . . 0.0 109.501 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -39.15 73.05 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.918 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.579 ' HA ' HD12 ' A' ' 90' ' ' ILE . 7.1 ttpt -61.11 -39.23 89.2 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.171 -0.955 . . . . 0.0 109.531 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -56.93 -34.9 68.43 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.141 -0.974 . . . . 0.0 110.212 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -58.12 -39.41 78.63 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.16 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 87' ' ' LYS . 10.9 mt -66.29 -40.88 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.401 0 O-C-N 121.176 -0.953 . . . . 0.0 109.219 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.1 m -58.9 -37.89 77.65 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.256 -0.903 . . . . 0.0 110.0 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -58.9 -40.47 84.58 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.154 -0.966 . . . . 0.0 109.822 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.941 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.7 m-70 -60.38 -49.66 76.7 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.155 -0.966 . . . . 0.0 109.75 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.451 HG13 ' CE1' ' A' ' 57' ' ' PHE . 13.9 mt -63.79 -39.4 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.215 -0.928 . . . . 0.0 109.565 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.18 -40.7 98.27 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.142 -0.974 . . . . 0.0 109.341 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -71.86 -38.3 70.08 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.261 -0.9 . . . . 0.0 109.226 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.0 tp -72.95 -37.34 67.16 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.271 -0.893 . . . . 0.0 109.951 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 m -65.28 -51.47 60.57 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.098 -1.001 . . . . 0.0 109.991 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.74 0 O-C-N 121.173 -0.955 . . . . 0.0 110.305 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 . . . . . 0 N--CA 1.495 1.792 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -124.51 131.61 53.49 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.266 -0.896 . . . . 0.0 110.185 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.718 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.5 m-85 -125.15 136.76 53.93 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.153 -0.967 . . . . 0.0 110.275 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.412 ' O ' HG23 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -121.89 164.12 18.09 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.243 -0.91 . . . . 0.0 109.062 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.479 HG13 ' HB3' ' A' ' 76' ' ' LEU . 25.4 m -130.95 134.98 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.945 -1.097 . . . . 0.0 110.465 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -139.67 156.69 46.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.151 -0.968 . . . . 0.0 110.2 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.622 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.5 OUTLIER -105.97 156.15 18.66 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.366 -0.834 . . . . 0.0 110.069 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.725 ' HB1' ' HA ' ' A' ' 26' ' ' VAL . . . -103.05 102.67 12.71 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.261 -0.899 . . . . 0.0 110.503 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -115.13 -56.21 2.39 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.303 -0.873 . . . . 0.0 109.94 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -114.91 83.19 1.86 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.202 -0.936 . . . . 0.0 110.029 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.675 ' O ' HG23 ' A' ' 26' ' ' VAL . . . 142.08 170.47 12.57 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -143.91 140.84 29.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.175 -1.191 . . . . 0.0 110.531 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.03 147.38 51.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.249 -0.907 . . . . 0.0 110.471 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.43 122.05 5.83 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.499 ' CA ' HD11 ' A' ' 25' ' ' ILE . 7.1 t -64.49 124.54 22.1 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.177 -1.19 . . . . 0.0 109.447 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 148.54 40.32 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.999 -1.063 . . . . 0.0 108.939 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 mttm 52.85 64.1 1.99 Allowed 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.982 -1.074 . . . . 0.0 108.984 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.5 t -172.98 -44.45 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.264 -0.897 . . . . 0.0 112.54 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt 70.08 44.15 0.81 Allowed 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.935 -1.103 . . . . 0.0 108.341 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -141.05 -170.05 2.96 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.539 -0.726 . . . . 0.0 109.364 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -127.6 156.02 42.93 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.883 -1.135 . . . . 0.0 110.92 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.905 HG23 ' CG1' ' A' ' 29' ' ' VAL . 15.8 mt -120.09 104.2 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -0.757 . . . . 0.0 109.615 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.725 ' HA ' ' HB1' ' A' ' 11' ' ' ALA . 10.1 p -163.84 147.59 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.084 -1.01 . . . . 0.0 111.578 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt 53.94 102.82 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.381 -0.824 . . . . 0.0 111.664 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.22 11.28 85.05 Favored Glycine 0 N--CA 1.494 2.549 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.012 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.905 ' CG1' HG23 ' A' ' 25' ' ' ILE . 93.1 t -121.78 135.2 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 CA-C-N 119.87 1.835 . . . . 0.0 110.634 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.889 ' HB3' HD11 ' A' ' 53' ' ' ILE . 1.7 t -105.75 141.19 37.61 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.26 -0.9 . . . . 0.0 108.829 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.631 ' HB3' HG21 ' A' ' 25' ' ' ILE . 3.2 ptp180 -122.21 144.66 48.83 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.154 -0.966 . . . . 0.0 111.408 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 7' ' ' CYS . 17.6 mt -107.16 137.51 37.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.339 -0.851 . . . . 0.0 109.412 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.446 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.32 128.2 9.39 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.164 -1.575 . . . . 0.0 109.164 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 30.0 tttt -112.23 117.53 32.79 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.192 -1.181 . . . . 0.0 109.973 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.8 t -100.55 109.04 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.072 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.3 t -120.79 124.38 27.54 Favored Pre-proline 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 109.773 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.85 142.58 35.47 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 O-C-N 123.146 1.077 . . . . 0.0 110.452 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 . . . . . 0 N--CA 1.499 2.003 0 O-C-N 121.16 -0.963 . . . . 0.0 110.216 179.777 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.609 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -146.09 135.11 22.63 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.16 -1.2 . . . . 0.0 110.351 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.5 mtp -117.62 141.52 48.28 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.194 -0.941 . . . . 0.0 110.366 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -130.42 127.71 39.86 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.132 -0.98 . . . . 0.0 110.25 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.92 153.57 42.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.122 -0.986 . . . . 0.0 110.088 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 56.6 m95 -105.98 129.6 54.07 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.194 -0.941 . . . . 0.0 109.949 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -112.41 177.11 4.75 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.21 -0.931 . . . . 0.0 111.162 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.447 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -94.69 -170.68 2.29 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.519 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.98 HG22 ' CE1' ' A' ' 93' ' ' HIS . 46.3 mm -88.3 -43.6 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.044 -1.035 . . . . 0.0 108.982 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -21.95 27.27 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.993 -1.067 . . . . 0.0 111.399 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 63.0 m -75.38 -43.68 48.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.683 -1.261 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.2 tpt -73.59 -39.33 64.7 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.733 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.666 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 10.1 m-85 -73.32 -30.21 63.21 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.967 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.42 -36.83 82.03 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.927 -1.108 . . . . 0.0 109.403 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -58.5 -38.64 78.09 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.991 -1.068 . . . . 0.0 109.888 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.2 -41.33 86.0 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.746 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -67.01 -33.58 75.87 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.3 -0.875 . . . . 0.0 110.647 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 18.2 ttt85 -86.5 -35.88 19.34 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.12 -0.988 . . . . 0.0 110.42 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.83 0 O-C-N 121.045 -1.034 . . . . 0.0 110.061 179.873 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt . . . . . 0 N--CA 1.493 1.708 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.778 HG12 HD11 ' A' ' 76' ' ' LEU . 77.5 mt 52.84 94.71 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.048 -1.033 . . . . 0.0 110.589 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -115.22 135.4 54.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.966 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 53.46 -165.25 0.08 Allowed 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.1 -1.0 . . . . 0.0 110.542 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.551 HD13 ' HB ' ' A' ' 91' ' ' THR . 8.3 tt -103.68 -48.12 4.04 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.171 -0.955 . . . . 0.0 110.354 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.31 69.62 4.54 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.125 -0.985 . . . . 0.0 109.817 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -143.49 -58.6 0.41 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.267 -0.896 . . . . 0.0 110.07 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.778 HD11 HG12 ' A' ' 70' ' ' ILE . 94.3 mt -62.52 151.59 37.12 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.163 -0.961 . . . . 0.0 109.564 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -79.94 128.84 33.95 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.184 -0.948 . . . . 0.0 110.262 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 143.71 -47.62 0.78 Allowed Glycine 0 N--CA 1.494 2.505 0 C-N-CA 119.753 -1.213 . . . . 0.0 110.588 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.45 ' HA ' HD12 ' A' ' 82' ' ' LEU . 45.9 p-90 -51.7 -30.54 22.51 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.917 -1.343 . . . . 0.0 111.216 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 5.8 tp10 -53.76 -27.91 31.45 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.963 -1.086 . . . . 0.0 111.332 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -111.74 26.95 10.11 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.821 -1.174 . . . . 0.0 112.064 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.622 HD13 ' CD2' ' A' ' 10' ' ' TYR . 29.9 mt -108.81 -164.27 0.93 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.812 -1.18 . . . . 0.0 109.555 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -94.98 161.89 13.96 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.957 -1.09 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -76.36 -47.9 21.79 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.238 -0.914 . . . . 0.0 109.999 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.3 -41.65 93.88 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.236 -0.915 . . . . 0.0 109.594 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 15.3 mt-10 -59.46 -39.98 85.4 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.291 -0.881 . . . . 0.0 109.628 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.871 ' HA ' HD12 ' A' ' 90' ' ' ILE . 3.6 ttpp -56.39 -39.23 72.63 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.207 -0.933 . . . . 0.0 109.97 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.536 ' O ' HG22 ' A' ' 91' ' ' THR . 3.1 tt0 -57.88 -37.92 74.82 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.263 -0.898 . . . . 0.0 109.961 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -70.07 -33.72 72.28 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.122 -0.986 . . . . 0.0 110.031 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 87' ' ' LYS . 11.9 mt -70.37 -38.64 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.11 -0.994 . . . . 0.0 110.003 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.551 ' HB ' HD13 ' A' ' 73' ' ' LEU . 9.5 t -69.04 -32.42 71.9 Favored 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 118.913 -1.115 . . . . 0.0 110.276 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.58 -39.89 70.29 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.992 -1.067 . . . . 0.0 108.781 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.98 ' CE1' HG22 ' A' ' 53' ' ' ILE . 70.0 t60 -56.27 -43.79 79.12 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.268 -0.895 . . . . 0.0 109.721 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.468 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 58.0 mt -67.94 -39.68 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.905 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.43 85.12 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.16 -0.963 . . . . 0.0 109.681 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.35 -42.29 95.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.16 -0.963 . . . . 0.0 109.377 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.4 HD22 ' HD1' ' A' ' 57' ' ' PHE . 5.6 tp -66.07 -35.86 81.65 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.297 -0.877 . . . . 0.0 109.859 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 73.6 m -105.09 58.6 0.68 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.156 -0.965 . . . . 0.0 109.971 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.493 1.72 0 O-C-N 121.091 -1.006 . . . . 0.0 110.283 -179.934 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 . . . . . 0 N--CA 1.496 1.847 0 CA-C-O 120.655 0.264 . . . . 0.0 110.322 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -139.69 131.85 28.09 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.235 -0.916 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.808 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.1 m-85 -125.4 139.95 53.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.166 -0.959 . . . . 0.0 110.25 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.5 m -127.39 163.19 24.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.921 . . . . 0.0 108.871 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.643 HG12 HG23 ' A' ' 32' ' ' ILE . 29.2 m -133.76 133.29 56.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.95 -1.094 . . . . 0.0 110.753 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -139.3 155.28 47.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.307 -0.871 . . . . 0.0 109.989 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -102.11 143.15 32.29 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.31 -0.869 . . . . 0.0 109.884 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.31 138.38 56.47 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.156 -0.965 . . . . 0.0 110.146 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mttt -130.05 -59.8 1.04 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 110.334 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.01 93.31 2.38 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.199 -0.938 . . . . 0.0 110.422 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.9 142.97 4.23 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.525 HG22 ' HA ' ' A' ' 26' ' ' VAL . 29.8 p -114.69 147.01 40.24 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.259 -1.142 . . . . 0.0 109.921 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.62 147.79 38.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.089 -1.007 . . . . 0.0 111.003 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.94 124.88 18.23 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.1 t -61.36 131.05 49.03 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.221 -1.164 . . . . 0.0 109.344 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm -62.22 148.17 45.57 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.156 -0.965 . . . . 0.0 109.269 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttt 52.45 47.42 24.75 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.972 -1.08 . . . . 0.0 109.673 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.3 t -164.8 153.03 12.06 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.31 -0.869 . . . . 0.0 110.895 -178.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 tttm -103.84 46.96 0.89 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -142.05 -174.37 4.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.404 -0.81 . . . . 0.0 110.197 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -133.2 156.27 47.82 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.222 -0.924 . . . . 0.0 109.727 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.731 HG21 ' HD3' ' A' ' 31' ' ' ARG . 62.2 mt -96.35 113.04 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.81 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.525 ' HA ' HG22 ' A' ' 15' ' ' THR . 67.9 t -108.51 162.78 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -41.44 133.15 2.59 Favored 'General case' 0 N--CA 1.519 3.02 0 O-C-N 121.689 -0.632 . . . . 0.0 111.527 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.8 4.31 45.61 Favored Glycine 0 N--CA 1.493 2.453 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.084 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.424 ' CG1' HG23 ' A' ' 25' ' ' ILE . 89.3 t -115.11 134.79 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-N 119.582 1.691 . . . . 0.0 109.546 179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.706 ' HB3' HD11 ' A' ' 53' ' ' ILE . 44.9 t -85.39 134.41 34.08 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.169 -0.957 . . . . 0.0 108.933 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.731 ' HD3' HG21 ' A' ' 25' ' ' ILE . 46.1 mtm105 -115.43 135.48 54.07 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.177 -0.952 . . . . 0.0 111.275 -178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.643 HG23 HG12 ' A' ' 8' ' ' VAL . 12.9 mt -104.7 129.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 178.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.1 131.71 10.7 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 22.7 tttt -110.78 113.45 26.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.327 -1.102 . . . . 0.0 109.566 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.73 107.62 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.148 -0.97 . . . . 0.0 110.198 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.407 HG13 ' O ' ' A' ' 36' ' ' VAL . 7.2 p -124.08 127.17 25.45 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.282 -0.886 . . . . 0.0 110.193 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.63 139.05 27.62 Favored 'Trans proline' 0 C--N 1.319 -0.983 0 O-C-N 123.088 1.046 . . . . 0.0 110.514 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.5 2.061 0 O-C-N 121.285 -0.885 . . . . 0.0 109.95 179.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.499 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -130.82 146.59 52.31 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.193 -1.18 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.2 ttm -115.66 149.08 38.93 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.191 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -129.23 148.75 51.2 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.552 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.47 155.28 48.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.57 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 71.0 m95 -98.13 156.87 16.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.122 -0.986 . . . . 0.0 110.157 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -136.15 172.99 12.2 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.317 -0.864 . . . . 0.0 110.546 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 0.3 OUTLIER -91.72 -170.42 2.58 Favored 'General case' 0 N--CA 1.504 2.232 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.585 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.842 HG22 ' CE1' ' A' ' 93' ' ' HIS . 42.1 mm -83.89 -60.02 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.161 179.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.424 ' HE2' ' CE1' ' A' ' 93' ' ' HIS . 23.7 mmtt -73.82 -27.42 61.11 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.927 -1.108 . . . . 0.0 111.262 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 52' ' ' HIS . 84.5 m -65.87 -51.47 58.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 120.741 -1.224 . . . . 0.0 110.253 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.671 ' HE1' HD11 ' A' ' 70' ' ' ILE . 0.6 OUTLIER -70.05 -39.55 75.65 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.814 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.458 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 8.6 m-85 -71.85 -28.56 63.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.2 -1.0 . . . . 0.0 109.944 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -67.38 -37.01 82.48 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.789 -1.194 . . . . 0.0 109.43 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -58.58 -40.49 83.29 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.023 -1.048 . . . . 0.0 109.755 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.22 -42.17 98.14 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.227 -0.921 . . . . 0.0 109.129 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -56.71 -33.83 66.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.152 -0.968 . . . . 0.0 109.67 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.8 mtt-85 -103.35 29.84 5.34 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.215 -0.928 . . . . 0.0 110.497 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.883 0 O-C-N 120.882 -1.136 . . . . 0.0 109.976 179.805 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 120.637 0.256 . . . . 0.0 110.461 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.671 HD11 ' HE1' ' A' ' 56' ' ' MET . 83.4 mt 54.54 101.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.949 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -110.23 141.17 43.55 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.158 -0.964 . . . . 0.0 109.789 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.6 t0 53.41 -169.9 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.035 -1.041 . . . . 0.0 110.416 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.536 ' HB2' HG23 ' A' ' 91' ' ' THR . 18.7 tp -118.52 38.58 3.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.105 -0.997 . . . . 0.0 110.648 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 35.98 0.82 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.132 -0.98 . . . . 0.0 110.55 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -131.43 29.45 4.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.201 -0.937 . . . . 0.0 110.559 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.808 HD22 ' HB3' ' A' ' 6' ' ' PHE . 96.4 mt -137.46 153.57 50.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.045 -1.034 . . . . 0.0 109.401 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.8 102.24 11.47 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.07 -1.018 . . . . 0.0 110.393 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.93 -39.11 0.6 Allowed Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.674 -1.25 . . . . 0.0 111.105 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.403 ' N ' ' CG2' ' A' ' 8' ' ' VAL . 46.6 p-90 -57.26 -32.17 66.32 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.832 -1.393 . . . . 0.0 110.913 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -53.26 -34.27 56.5 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.832 -1.167 . . . . 0.0 110.612 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.86 -36.06 31.89 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.999 -1.063 . . . . 0.0 110.295 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.02 176.91 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.965 -1.084 . . . . 0.0 110.66 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -104.02 160.4 14.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.078 -1.014 . . . . 0.0 110.406 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -60.44 -46.01 91.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.238 -0.914 . . . . 0.0 110.086 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -61.56 -48.04 82.79 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.553 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -64.66 -40.59 95.69 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.429 -0.909 . . . . 0.0 109.197 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.408 ' O ' ' OG1' ' A' ' 91' ' ' THR . 12.5 tttm -62.3 -38.9 91.17 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.347 -0.846 . . . . 0.0 109.911 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.07 -41.12 97.84 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.196 -0.94 . . . . 0.0 109.893 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -66.89 -38.04 85.53 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.244 -0.91 . . . . 0.0 110.081 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.14 -38.5 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.124 -0.985 . . . . 0.0 109.338 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.536 HG23 ' HB2' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -59.24 -39.03 81.47 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.135 -0.978 . . . . 0.0 109.811 179.472 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -56.02 -36.76 68.33 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.063 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.842 ' CE1' HG22 ' A' ' 53' ' ' ILE . 0.2 OUTLIER -58.82 -51.61 69.26 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.677 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.458 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.2 mt -60.79 -37.59 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.225 -0.922 . . . . 0.0 109.704 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.09 86.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.168 -0.957 . . . . 0.0 109.62 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.37 -43.35 77.56 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.232 -0.917 . . . . 0.0 108.791 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.73 -35.06 79.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.315 -0.865 . . . . 0.0 109.77 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.3 m -100.62 66.59 1.23 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.981 -1.074 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.126 -0.984 . . . . 0.0 110.177 179.997 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 . . . . . 0 N--CA 1.496 1.829 0 CA-C-O 120.723 0.296 . . . . 0.0 110.337 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.2 137.86 31.08 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.217 -0.927 . . . . 0.0 110.191 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.718 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -117.25 142.13 47.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.9 m -130.51 165.0 23.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.262 -0.899 . . . . 0.0 109.314 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.8 m -130.64 139.83 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.066 -1.022 . . . . 0.0 110.641 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.02 107.66 4.12 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.239 -0.913 . . . . 0.0 110.35 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.791 ' CD2' HD13 ' A' ' 82' ' ' LEU . 10.5 m-85 -58.9 153.03 18.13 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.162 -0.961 . . . . 0.0 110.054 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.75 136.55 48.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.309 -0.869 . . . . 0.0 110.311 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -120.16 -57.34 1.94 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.253 -0.904 . . . . 0.0 110.306 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -128.24 122.99 33.06 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.097 -1.002 . . . . 0.0 110.161 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.98 170.88 11.96 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.815 HG23 ' CG1' ' A' ' 26' ' ' VAL . 57.4 m -140.98 135.44 31.17 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.18 -1.188 . . . . 0.0 110.126 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.44 137.17 26.8 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.16 -0.963 . . . . 0.0 110.734 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.6 123.21 15.73 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.6 t -62.37 130.9 47.39 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.246 -1.15 . . . . 0.0 109.46 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -62.41 147.33 48.89 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.117 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? 52.5 48.21 23.06 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.02 -1.05 . . . . 0.0 109.579 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -164.93 153.3 12.04 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.401 -0.812 . . . . 0.0 110.852 -178.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -104.05 46.27 0.92 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -143.28 -174.63 4.26 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.498 -0.751 . . . . 0.0 110.077 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -136.16 155.5 50.06 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.112 -0.993 . . . . 0.0 109.727 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.604 HG23 HG11 ' A' ' 29' ' ' VAL . 59.5 mt -103.86 118.29 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.303 -0.873 . . . . 0.0 109.709 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.815 ' CG1' HG23 ' A' ' 15' ' ' THR . 29.7 m -137.48 89.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.106 -0.996 . . . . 0.0 111.251 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 tttm 60.3 149.45 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.081 -1.012 . . . . 0.0 111.318 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.13 9.18 80.25 Favored Glycine 0 N--CA 1.496 2.678 0 C-N-CA 120.245 -0.978 . . . . 0.0 111.712 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.604 HG11 HG23 ' A' ' 25' ' ' ILE . 80.1 t -127.6 135.17 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-N 119.712 1.756 . . . . 0.0 110.247 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.781 ' HB3' HD11 ' A' ' 53' ' ' ILE . 5.7 t -87.47 120.96 29.3 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.592 ' HD3' HG21 ' A' ' 25' ' ' ILE . 44.6 mtm180 -101.69 129.8 47.93 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.939 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.442 HD12 ' HG2' ' A' ' 56' ' ' MET . 18.9 mt -103.82 131.06 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.13 126.0 8.77 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.419 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 40.4 tttt -107.48 116.99 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.289 -1.124 . . . . 0.0 109.741 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.87 111.96 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.097 -1.002 . . . . 0.0 110.106 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 73.7 t -120.37 113.64 33.63 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.247 -0.908 . . . . 0.0 109.794 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.35 147.24 46.76 Favored 'Trans proline' 0 N--CA 1.485 1.018 0 O-C-N 123.202 1.106 . . . . 0.0 110.47 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 . . . . . 0 N--CA 1.5 2.053 0 O-C-N 121.327 -0.858 . . . . 0.0 110.233 179.846 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.467 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -122.02 143.29 49.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.198 -1.177 . . . . 0.0 110.271 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -117.15 129.66 56.11 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.244 -0.91 . . . . 0.0 110.26 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -122.99 136.0 54.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -139.76 155.8 47.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.131 -0.981 . . . . 0.0 109.923 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 51.8 m95 -98.11 163.01 12.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.185 -0.947 . . . . 0.0 110.138 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -143.66 172.69 12.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.265 -0.897 . . . . 0.0 110.683 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 1.9 m80 -91.71 -172.07 3.09 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.954 HG22 ' CE1' ' A' ' 93' ' ' HIS . 44.6 mm -83.38 -47.1 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 C-N-CA 119.117 -1.033 . . . . 0.0 109.047 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.7 mtmt -80.22 -32.89 38.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.798 -1.189 . . . . 0.0 110.717 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 70.8 m -62.67 -50.92 69.28 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.939 -1.101 . . . . 0.0 110.235 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.442 ' HG2' HD12 ' A' ' 32' ' ' ILE . 10.0 tpt -68.0 -42.22 81.08 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.842 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.65 ' HD1' HD22 ' A' ' 97' ' ' LEU . 9.8 m-85 -69.27 -30.71 68.88 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.647 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.61 -37.82 85.36 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.962 -1.086 . . . . 0.0 109.417 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -58.18 -39.19 78.26 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.027 -1.046 . . . . 0.0 109.903 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.7 mp -58.1 -41.78 84.28 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.154 -0.966 . . . . 0.0 109.346 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -57.95 -34.12 69.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.236 -0.915 . . . . 0.0 109.589 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -104.4 30.46 5.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.196 -0.94 . . . . 0.0 110.525 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.021 0 O-C-N 120.892 -1.13 . . . . 0.0 110.071 179.786 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.576 HG23 HD11 ' A' ' 76' ' ' LEU . 73.4 mt 54.97 99.21 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 O-C-N 121.126 -0.984 . . . . 0.0 110.469 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -109.49 139.91 43.9 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.156 -0.965 . . . . 0.0 110.31 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.17 -176.73 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.092 -1.005 . . . . 0.0 110.896 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.871 HD11 HG23 ' A' ' 90' ' ' ILE . 15.0 tp -98.73 -29.65 12.89 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.25 42.88 1.08 Allowed 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.779 -1.201 . . . . 0.0 110.404 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -122.06 34.7 5.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.142 -0.974 . . . . 0.0 110.192 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 6' ' ' PHE . 57.3 mt -145.8 153.71 41.22 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.05 -1.031 . . . . 0.0 109.963 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -85.13 116.37 23.46 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.046 -1.034 . . . . 0.0 110.442 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 148.49 -40.92 0.9 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.744 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.403 ' HA ' HD12 ' A' ' 82' ' ' LEU . 48.9 p-90 -61.93 -26.1 67.98 Favored 'General case' 0 N--CA 1.513 2.684 0 O-C-N 121.069 -1.253 . . . . 0.0 111.538 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -53.05 -28.04 22.75 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 120.788 -1.195 . . . . 0.0 111.465 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -112.77 28.45 8.78 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.809 -1.182 . . . . 0.0 112.116 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.791 HD13 ' CD2' ' A' ' 10' ' ' TYR . 25.8 mt -109.76 -166.1 1.07 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.714 -1.242 . . . . 0.0 109.918 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -97.74 162.83 13.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.101 -0.999 . . . . 0.0 110.333 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -81.96 -39.89 23.02 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.212 -0.93 . . . . 0.0 110.306 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -61.85 -50.54 71.86 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.19 -0.944 . . . . 0.0 109.596 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 10.7 mt-10 -61.75 -41.49 97.73 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.289 -0.882 . . . . 0.0 109.227 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.562 ' O ' HG22 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -59.17 -34.36 72.02 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.259 -0.901 . . . . 0.0 110.208 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.71 -35.3 76.99 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.053 -1.029 . . . . 0.0 110.236 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.04 -41.32 77.81 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.969 -1.082 . . . . 0.0 110.201 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.871 HG23 HD11 ' A' ' 73' ' ' LEU . 4.5 tt -65.04 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.223 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.858 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -65.4 -40.01 92.92 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.846 -1.159 . . . . 0.0 109.317 178.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -35.33 63.56 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.277 -0.89 . . . . 0.0 110.247 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.954 ' CE1' HG22 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -56.8 -47.29 80.55 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 121.037 -1.04 . . . . 0.0 109.922 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.453 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 16.6 mt -63.63 -37.48 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.114 -0.991 . . . . 0.0 109.724 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.09 -39.56 95.08 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.144 -0.973 . . . . 0.0 109.664 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.13 -36.8 69.5 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.2 -0.937 . . . . 0.0 109.801 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.65 HD22 ' HD1' ' A' ' 57' ' ' PHE . 8.2 tp -79.76 -30.95 40.88 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.179 -0.951 . . . . 0.0 110.584 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 66.9 m -93.08 -38.14 11.78 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.835 -1.165 . . . . 0.0 110.349 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.497 1.904 0 O-C-N 121.127 -0.983 . . . . 0.0 110.157 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 . . . . . 0 N--CA 1.495 1.813 0 N-CA-C 110.154 -0.313 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -123.64 125.95 45.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.191 -0.943 . . . . 0.0 110.414 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.693 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -116.72 137.39 52.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.264 -0.898 . . . . 0.0 109.894 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.4 t -125.89 154.34 42.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 109.138 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.803 HG12 HG23 ' A' ' 32' ' ' ILE . 28.9 m -129.44 143.33 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.954 -1.091 . . . . 0.0 110.326 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -158.22 138.15 12.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.185 -0.947 . . . . 0.0 110.986 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.461 ' OH ' ' HB2' ' A' ' 86' ' ' GLU . 1.7 m-85 -53.53 155.73 2.86 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 121.093 -1.004 . . . . 0.0 110.424 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.479 ' CB ' HG22 ' A' ' 25' ' ' ILE . . . -88.17 150.98 23.01 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 119.535 -0.866 . . . . 0.0 109.652 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -105.05 -163.64 0.97 Allowed 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.16 -0.963 . . . . 0.0 110.337 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -89.51 61.24 5.48 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.159 -0.963 . . . . 0.0 110.037 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.764 ' O ' HG22 ' A' ' 26' ' ' VAL . . . -130.27 -164.88 11.45 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.315 -1.514 . . . . 0.0 109.315 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 p -117.94 110.81 18.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.299 -1.118 . . . . 0.0 110.012 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.51 99.35 5.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.129 -0.982 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.36 119.29 13.85 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.0 t -59.79 128.94 39.41 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.195 -1.18 . . . . 0.0 109.83 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -62.2 148.76 43.65 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.111 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt 52.71 45.05 29.45 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.991 -1.068 . . . . 0.0 109.647 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.4 t -164.74 153.45 12.6 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.35 -0.844 . . . . 0.0 110.742 -178.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.89 48.4 0.86 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.261 -0.899 . . . . 0.0 108.582 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -144.48 -174.65 4.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.467 -0.77 . . . . 0.0 110.286 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.85 157.08 44.95 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.186 -0.946 . . . . 0.0 109.871 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.733 HG23 ' HB ' ' A' ' 29' ' ' VAL . 38.3 mt -110.56 113.51 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 109.579 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.764 HG22 ' O ' ' A' ' 14' ' ' GLY . 62.1 t -134.33 90.19 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.06 -1.025 . . . . 0.0 110.569 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.87 134.6 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.348 -0.845 . . . . 0.0 111.194 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.96 -24.12 33.6 Favored Glycine 0 N--CA 1.495 2.601 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.19 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.733 ' HB ' HG23 ' A' ' 25' ' ' ILE . 57.9 t -114.38 136.95 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 CA-C-N 119.262 1.531 . . . . 0.0 110.373 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.27 139.5 39.84 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.4 -0.92 . . . . 0.0 108.851 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HG2' HG21 ' A' ' 25' ' ' ILE . 44.0 mtm-85 -107.82 137.28 46.1 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.109 -0.995 . . . . 0.0 110.811 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.803 HG23 HG12 ' A' ' 8' ' ' VAL . 4.5 mt -109.01 125.13 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.6 122.28 7.46 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.656 -1.377 . . . . 0.0 109.656 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.448 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.6 ttpm? -104.45 113.07 26.39 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.414 -1.05 . . . . 0.0 109.469 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.0 t -97.45 107.21 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.174 -0.954 . . . . 0.0 110.04 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.434 HG23 ' HD2' ' A' ' 37' ' ' PRO . 9.7 p -124.66 143.27 42.99 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.434 ' HD2' HG23 ' A' ' 36' ' ' VAL . 47.8 Cg_endo -74.03 151.55 44.82 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 O-C-N 123.209 1.11 . . . . 0.0 110.412 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 . . . . . 0 N--CA 1.5 2.034 0 O-C-N 121.303 -0.873 . . . . 0.0 110.102 179.811 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.576 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -108.48 146.58 32.96 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.202 -1.175 . . . . 0.0 110.004 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.3 mtt -115.62 144.49 43.83 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.574 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -123.1 129.63 51.72 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.265 -0.897 . . . . 0.0 109.99 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -125.26 159.31 31.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.152 -0.968 . . . . 0.0 110.209 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.418 ' CE3' ' HB3' ' A' ' 31' ' ' ARG . 72.5 m95 -104.31 134.13 48.05 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.241 -0.912 . . . . 0.0 110.017 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -116.25 173.0 6.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.255 -0.903 . . . . 0.0 110.714 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.618 ' HD2' HG11 ' A' ' 29' ' ' VAL . 1.1 m170 -93.26 -171.79 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.986 HG22 ' CE1' ' A' ' 93' ' ' HIS . 49.3 mm -85.63 -45.0 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 C-N-CA 118.943 -1.103 . . . . 0.0 109.004 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -21.66 29.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.042 -1.037 . . . . 0.0 111.341 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 59.5 m -78.24 -41.69 33.5 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.753 -1.217 . . . . 0.0 109.759 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.35 -38.15 60.25 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.743 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.684 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 11.4 m-85 -71.76 -30.22 65.35 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.677 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -61.16 -37.01 81.36 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.921 -1.112 . . . . 0.0 109.497 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -58.87 -40.08 83.28 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.029 -1.044 . . . . 0.0 109.826 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.406 ' HB3' HD21 ' A' ' 97' ' ' LEU . 9.4 mp -58.96 -42.93 91.07 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.187 -0.946 . . . . 0.0 109.305 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -57.74 -34.14 69.2 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.296 -0.878 . . . . 0.0 109.68 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.05 29.68 5.75 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.212 -0.93 . . . . 0.0 110.589 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.886 0 O-C-N 120.882 -1.136 . . . . 0.0 109.971 179.77 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.9 mttt . . . . . 0 N--CA 1.494 1.747 0 CA-C-O 120.806 0.336 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 76' ' ' LEU . 79.0 mt 53.6 96.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.162 -0.961 . . . . 0.0 110.76 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -115.69 133.06 56.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.135 -0.978 . . . . 0.0 109.936 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 51.49 -172.9 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.076 -1.015 . . . . 0.0 110.735 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.815 HD13 HG21 ' A' ' 90' ' ' ILE . 50.4 tp -117.19 84.33 2.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.134 -0.979 . . . . 0.0 110.397 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -171.91 -51.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.17 -0.956 . . . . 0.0 110.744 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -51.0 -30.87 16.34 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.113 -0.992 . . . . 0.0 111.23 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.693 HD22 ' HB3' ' A' ' 6' ' ' PHE . 30.8 mt -74.73 153.87 38.65 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.919 -1.113 . . . . 0.0 109.964 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -99.38 119.05 37.34 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.198 -0.939 . . . . 0.0 111.065 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.83 -38.81 1.46 Allowed Glycine 0 N--CA 1.495 2.567 0 N-CA-C 110.266 -1.133 . . . . 0.0 110.266 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.418 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 59.7 p-90 -51.39 -34.91 36.53 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.017 -1.284 . . . . 0.0 110.937 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.418 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 6.4 tt0 -54.79 -35.9 64.33 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.982 -1.074 . . . . 0.0 110.565 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -80.54 -36.8 32.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.034 -1.041 . . . . 0.0 110.286 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.49 HD23 ' HG3' ' A' ' 86' ' ' GLU . 7.2 mp -48.9 172.74 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.131 -0.98 . . . . 0.0 111.206 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -105.11 163.2 12.74 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.212 -0.93 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -52.42 -39.42 60.97 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.179 -0.95 . . . . 0.0 110.798 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.97 -52.13 65.28 Favored 'General case' 0 N--CA 1.508 2.455 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.635 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.49 ' HG3' HD23 ' A' ' 82' ' ' LEU . 14.0 tp10 -64.09 -40.97 97.38 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.435 -0.906 . . . . 0.0 109.065 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.539 ' HG3' HD21 ' A' ' 73' ' ' LEU . 33.3 tttt -63.99 -39.39 94.0 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.694 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.33 -40.73 97.31 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.58 -37.81 88.85 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.06 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.815 HG21 HD13 ' A' ' 73' ' ' LEU . 42.0 mm -64.86 -41.73 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 47.2 p -63.16 -47.08 84.19 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.426 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -64.25 -40.56 96.26 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.981 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.986 ' CE1' HG22 ' A' ' 53' ' ' ILE . 64.6 t60 -61.15 -43.55 98.7 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.435 HG12 ' CE2' ' A' ' 57' ' ' PHE . 19.1 mt -70.44 -38.72 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 O-C-N 121.159 -0.963 . . . . 0.0 108.839 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.09 91.29 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.137 -0.977 . . . . 0.0 109.375 178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.77 -37.0 80.38 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.165 -0.959 . . . . 0.0 109.829 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.561 HD22 ' HD2' ' A' ' 57' ' ' PHE . 5.0 tp -88.07 -33.33 18.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.401 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.3 m -102.17 54.51 0.8 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.945 -1.097 . . . . 0.0 110.206 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.494 1.769 0 O-C-N 121.178 -0.951 . . . . 0.0 110.22 179.881 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 . . . . . 0 N--CA 1.494 1.738 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 mmt-85 -116.29 134.17 55.2 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.232 -0.917 . . . . 0.0 110.039 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.649 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.3 m-85 -116.99 144.99 43.94 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.169 -0.957 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.0 t -131.56 153.09 50.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.351 -0.843 . . . . 0.0 108.952 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.523 HG12 HG23 ' A' ' 32' ' ' ILE . 24.2 m -126.95 132.0 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 O-C-N 120.994 -1.066 . . . . 0.0 110.568 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -147.68 159.63 43.57 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.087 -1.008 . . . . 0.0 110.561 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.407 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -100.41 155.74 17.65 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.453 -0.78 . . . . 0.0 109.968 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.552 ' HB2' ' NE ' ' A' ' 31' ' ' ARG . . . -107.61 138.68 43.39 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.361 -0.837 . . . . 0.0 110.292 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 tttt -150.23 127.73 11.51 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.248 -0.907 . . . . 0.0 110.605 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 ttt85 54.71 99.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.093 -1.004 . . . . 0.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.869 ' O ' HG21 ' A' ' 26' ' ' VAL . . . 144.86 -151.41 23.55 Favored Glycine 0 N--CA 1.496 2.665 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.622 HG23 ' O ' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -158.02 138.44 12.72 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.195 -1.179 . . . . 0.0 110.593 -179.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.98 107.16 4.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.157 -0.964 . . . . 0.0 110.539 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.67 114.72 7.13 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.451 ' CB ' HD11 ' A' ' 25' ' ' ILE . 24.6 t -61.06 128.49 36.71 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.207 -1.172 . . . . 0.0 109.521 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.426 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 19.1 tptt -61.8 148.09 44.27 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.196 -0.94 . . . . 0.0 109.091 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.3 mttt 52.74 45.62 28.35 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.946 -1.096 . . . . 0.0 109.669 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.8 t -165.21 154.08 12.21 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.362 -0.836 . . . . 0.0 110.783 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -105.5 44.04 1.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -141.43 -177.11 4.99 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.015 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -126.71 161.68 27.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.019 -1.051 . . . . 0.0 110.264 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.93 HG23 ' CG1' ' A' ' 29' ' ' VAL . 7.1 mt -120.17 102.92 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.409 -0.807 . . . . 0.0 109.997 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.869 HG21 ' O ' ' A' ' 14' ' ' GLY . 9.5 p -162.32 143.93 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.24 -0.913 . . . . 0.0 111.266 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.9 tptp 52.84 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.261 -0.9 . . . . 0.0 111.558 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.51 9.31 83.59 Favored Glycine 0 N--CA 1.496 2.652 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.061 179.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.93 ' CG1' HG23 ' A' ' 25' ' ' ILE . 58.9 t -124.49 135.14 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 119.891 1.846 . . . . 0.0 110.582 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.637 ' HB3' HD11 ' A' ' 53' ' ' ILE . 43.4 t -102.0 140.01 36.87 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.301 -0.875 . . . . 0.0 108.767 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.842 ' HB3' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -129.23 150.33 50.65 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.124 -0.985 . . . . 0.0 111.401 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.523 HG23 HG12 ' A' ' 8' ' ' VAL . 19.2 mt -110.81 138.27 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.444 -0.785 . . . . 0.0 108.997 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.12 125.89 8.56 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.165 -1.574 . . . . 0.0 109.165 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.431 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 22.0 ttmt -107.51 120.54 42.47 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.238 -1.154 . . . . 0.0 109.804 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.5 t -101.63 107.5 21.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.058 -1.026 . . . . 0.0 110.28 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.444 HG23 ' HD2' ' A' ' 37' ' ' PRO . 8.4 p -124.66 143.5 43.66 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.444 ' HD2' HG23 ' A' ' 36' ' ' VAL . 46.6 Cg_endo -72.96 126.36 11.2 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 O-C-N 123.089 1.047 . . . . 0.0 110.228 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 N--CA 1.5 2.03 0 O-C-N 121.165 -0.959 . . . . 0.0 110.231 179.834 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.466 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -115.78 138.85 50.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.259 -1.142 . . . . 0.0 110.257 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.6 ttt -117.25 143.62 45.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.221 -0.924 . . . . 0.0 110.385 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -117.99 128.51 54.85 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.249 -0.907 . . . . 0.0 110.139 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -122.95 148.59 45.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.21 -0.931 . . . . 0.0 109.777 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 23.4 m95 -94.23 163.25 13.52 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.137 -0.977 . . . . 0.0 109.94 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.426 ' CE1' ' HB3' ' A' ' 19' ' ' LYS . 89.0 m-85 -146.29 174.82 11.01 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.307 -0.871 . . . . 0.0 110.459 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CD2' HG12 ' A' ' 25' ' ' ILE . 1.8 m80 -99.44 -175.79 3.1 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.331 -0.855 . . . . 0.0 108.831 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.929 HG22 ' CE1' ' A' ' 93' ' ' HIS . 49.8 mm -83.98 -34.34 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 O-C-N 121.076 -1.015 . . . . 0.0 109.582 178.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -91.38 -32.45 15.65 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.695 -1.253 . . . . 0.0 110.594 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 70.9 m -63.46 -52.38 61.65 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.959 -1.088 . . . . 0.0 110.744 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.411 ' HB2' ' HB3' ' A' ' 51' ' ' TYR . 11.7 tpt -67.76 -38.27 83.23 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.42 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 13.2 m-85 -76.77 -27.0 55.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.015 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -75.21 -37.12 61.27 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.836 -1.165 . . . . 0.0 109.407 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -40.85 82.32 Favored 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.31 179.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.854 HD23 HD21 ' A' ' 97' ' ' LEU . 3.8 tp -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.405 -0.809 . . . . 0.0 109.606 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -70.31 -33.32 71.38 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.181 -0.949 . . . . 0.0 110.424 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -30.62 21.31 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.11 -0.994 . . . . 0.0 111.059 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.995 0 O-C-N 120.877 -1.139 . . . . 0.0 110.434 -179.862 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mttp . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 120.749 0.309 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.7 mt 55.69 99.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.179 -0.951 . . . . 0.0 110.538 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.55 143.62 44.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.205 -0.934 . . . . 0.0 110.001 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.26 -172.33 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.093 -1.005 . . . . 0.0 110.423 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.958 HD22 HG23 ' A' ' 91' ' ' THR . 13.2 tp -122.54 37.38 4.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.218 -0.926 . . . . 0.0 110.71 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -144.42 36.56 1.21 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.085 -1.01 . . . . 0.0 110.404 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -134.98 33.53 3.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.245 -0.909 . . . . 0.0 110.101 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.649 HD22 ' HB3' ' A' ' 6' ' ' PHE . 55.2 mt -138.91 156.36 47.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.093 -1.004 . . . . 0.0 109.729 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -86.55 104.66 16.2 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.167 -0.958 . . . . 0.0 110.875 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.97 -30.12 2.28 Favored Glycine 0 N--CA 1.495 2.604 0 C-N-CA 119.519 -1.324 . . . . 0.0 111.806 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.424 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 19.0 p-90 -57.65 -34.23 69.13 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 119.492 1.646 . . . . 0.0 110.761 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.424 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 23.5 tt0 -55.78 -35.61 66.46 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.943 -1.098 . . . . 0.0 110.487 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -74.49 -32.77 62.65 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.03 -1.044 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.8 174.44 0.02 OUTLIER 'General case' 0 N--CA 1.519 2.979 0 O-C-N 120.971 -1.081 . . . . 0.0 110.913 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -105.43 161.77 14.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.175 -0.953 . . . . 0.0 110.452 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.54 -50.12 74.91 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.226 -0.921 . . . . 0.0 110.347 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -61.18 -37.2 82.06 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.238 -0.914 . . . . 0.0 110.203 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.407 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 55.4 mt-10 -73.27 -41.22 63.88 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.132 -0.98 . . . . 0.0 108.805 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.478 ' O ' HG22 ' A' ' 90' ' ' ILE . 34.7 tttt -58.89 -34.86 72.13 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.372 -0.83 . . . . 0.0 109.949 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -65.13 -35.6 81.62 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.091 -1.006 . . . . 0.0 109.987 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -67.51 -47.31 70.33 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.981 -1.074 . . . . 0.0 110.083 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.478 HG22 ' O ' ' A' ' 87' ' ' LYS . 18.2 tt -63.98 -34.43 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.437 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.823 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.958 HG23 HD22 ' A' ' 73' ' ' LEU . 0.8 OUTLIER -63.35 -39.38 94.39 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.912 -1.117 . . . . 0.0 109.179 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -55.77 -38.63 70.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.141 -0.974 . . . . 0.0 109.969 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.929 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.4 m-70 -60.69 -53.33 58.69 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.196 -0.94 . . . . 0.0 109.837 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.449 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.6 mt -61.94 -38.73 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.484 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.24 93.18 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.156 -0.965 . . . . 0.0 109.508 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.53 -43.4 76.82 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.234 -0.916 . . . . 0.0 108.797 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.854 HD21 HD23 ' A' ' 60' ' ' LEU . 13.6 tp -60.56 -34.97 74.94 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.282 -0.886 . . . . 0.0 109.962 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.7 m -98.14 50.91 1.02 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.088 -1.007 . . . . 0.0 110.116 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 9.5 t . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.125 -0.985 . . . . 0.0 110.056 -179.957 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 . . . . . 0 N--CA 1.497 1.922 0 CA-C-O 120.615 0.245 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -125.08 143.99 50.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.208 -0.933 . . . . 0.0 110.165 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.539 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.7 m-85 -118.78 149.57 41.27 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.289 -0.882 . . . . 0.0 110.209 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.437 ' O ' HG23 ' A' ' 32' ' ' ILE . 10.4 m -135.41 164.81 26.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.254 -0.904 . . . . 0.0 109.421 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.466 ' HB ' HD23 ' A' ' 76' ' ' LEU . 3.9 p -139.29 112.87 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.053 -1.03 . . . . 0.0 110.231 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -125.77 142.97 51.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 109.699 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.454 ' CD1' ' HB3' ' A' ' 82' ' ' LEU . 95.9 m-85 -99.6 137.75 37.65 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.229 -0.919 . . . . 0.0 109.667 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.58 134.66 46.72 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.043 -1.036 . . . . 0.0 110.742 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 32.4 tttt -119.63 -58.02 1.93 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.239 -0.913 . . . . 0.0 110.014 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -147.82 38.61 0.92 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.219 -0.925 . . . . 0.0 110.513 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -146.92 157.56 27.45 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.471 HG22 ' HA ' ' A' ' 26' ' ' VAL . 75.4 p -140.53 140.73 35.28 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.21 -1.171 . . . . 0.0 110.205 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -161.0 151.12 17.56 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.206 -0.934 . . . . 0.0 111.398 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -54.46 127.02 38.74 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 108.822 -1.711 . . . . 0.0 108.822 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.73 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 23.4 p -64.53 127.9 33.49 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.272 -1.134 . . . . 0.0 110.826 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 1.2 mptm? -75.82 156.51 34.39 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.52 -0.738 . . . . 0.0 109.308 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 tptp 65.89 16.25 10.4 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.904 -1.122 . . . . 0.0 111.529 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.73 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 9.3 p -174.83 149.14 1.14 Allowed 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.572 -1.33 . . . . 0.0 110.646 178.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 tttt -85.07 88.84 7.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.986 -1.071 . . . . 0.0 111.776 -177.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.422 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.0 tt0 -166.97 -174.56 2.73 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.277 -0.889 . . . . 0.0 110.408 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.09 152.73 47.63 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.039 -1.038 . . . . 0.0 109.656 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.502 HD13 ' HD3' ' A' ' 31' ' ' ARG . 80.9 mt -105.25 118.82 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.344 -0.847 . . . . 0.0 110.024 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 29' ' ' VAL . 57.2 t -115.65 159.0 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.228 -0.92 . . . . 0.0 109.96 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -49.99 132.94 23.1 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.28 -0.888 . . . . 0.0 110.752 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.37 9.7 40.76 Favored Glycine 0 N--CA 1.494 2.531 0 C-N-CA 120.083 -1.056 . . . . 0.0 111.591 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.8 p -123.65 135.13 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 CA-C-N 119.682 1.741 . . . . 0.0 110.536 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 23.8 p -87.01 141.59 28.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.229 -0.92 . . . . 0.0 110.239 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.502 ' HD3' HD13 ' A' ' 25' ' ' ILE . 2.2 ptt180 -138.85 144.52 39.26 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -0.943 . . . . 0.0 110.349 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.437 HG23 ' O ' ' A' ' 7' ' ' CYS . 12.2 mt -106.51 126.9 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.222 -0.924 . . . . 0.0 109.277 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.0 133.74 11.54 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.251 -1.539 . . . . 0.0 109.251 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.467 ' HE2' HG21 ' A' ' 36' ' ' VAL . 33.0 tttt -103.77 121.83 43.83 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.159 -1.201 . . . . 0.0 109.298 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.97 112.6 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.154 -0.966 . . . . 0.0 110.411 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.467 HG21 ' HE2' ' A' ' 34' ' ' LYS . 65.3 t -120.37 141.4 31.86 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.141 -0.975 . . . . 0.0 109.727 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -74.63 129.64 12.89 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.259 1.137 . . . . 0.0 110.431 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 . . . . . 0 N--CA 1.499 1.991 0 O-C-N 121.149 -0.969 . . . . 0.0 110.107 179.594 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.52 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -107.6 146.96 31.25 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.228 -1.16 . . . . 0.0 110.068 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.4 ttm -117.08 151.51 36.66 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.187 -0.946 . . . . 0.0 110.608 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HD2' ' CZ2' ' A' ' 50' ' ' TRP . 7.8 pttt -131.71 142.7 49.87 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.341 -0.849 . . . . 0.0 109.905 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -120.8 134.23 55.3 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.102 -0.999 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CZ2' ' HD2' ' A' ' 48' ' ' LYS . 17.0 m95 -91.56 114.47 27.01 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.074 -1.016 . . . . 0.0 110.591 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.539 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 0.8 OUTLIER -125.44 171.0 10.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.611 177.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.48 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 71.0 m80 -87.74 -173.5 4.34 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.49 -0.756 . . . . 0.0 110.028 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.554 HG22 ' ND1' ' A' ' 93' ' ' HIS . 30.8 mm -84.61 -52.75 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -60.22 -37.85 81.57 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.222 -0.924 . . . . 0.0 109.259 178.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -61.49 -51.29 69.26 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.25 -0.906 . . . . 0.0 109.083 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.42 ' HB2' ' CD1' ' A' ' 51' ' ' TYR . 9.0 tpt -68.94 -44.41 73.1 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.339 -0.851 . . . . 0.0 109.302 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 10.6 m-85 -64.12 -29.72 70.83 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 119.157 -1.017 . . . . 0.0 109.721 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.48 -40.09 85.86 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.989 -1.069 . . . . 0.0 109.391 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -66.22 -40.17 90.1 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.236 -0.915 . . . . 0.0 109.114 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.6 mp -57.8 -42.18 83.65 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.205 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -58.84 -35.65 73.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.221 -0.924 . . . . 0.0 109.53 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -105.23 30.56 5.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.228 -0.92 . . . . 0.0 110.457 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.78 0 O-C-N 121.022 -1.049 . . . . 0.0 110.072 179.967 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 120.692 0.282 . . . . 0.0 110.263 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.7 mt 54.49 100.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.079 0 O-C-N 121.197 -0.939 . . . . 0.0 110.804 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -107.02 134.09 50.69 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.126 -0.984 . . . . 0.0 109.577 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 53.83 -163.65 0.1 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.996 -1.065 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.71 HD21 ' HG2' ' A' ' 87' ' ' LYS . 58.1 tp -103.87 73.87 1.19 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.984 -1.073 . . . . 0.0 109.811 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.85 -160.0 0.32 Allowed 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.182 -0.949 . . . . 0.0 110.406 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.609 ' O ' HD12 ' A' ' 76' ' ' LEU . 4.8 mm-40 54.6 38.89 30.7 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.911 -1.118 . . . . 0.0 110.238 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.609 HD12 ' O ' ' A' ' 75' ' ' GLU . 1.1 tp -141.85 150.92 42.22 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.304 -0.873 . . . . 0.0 109.412 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -100.89 104.47 15.68 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.137 -0.977 . . . . 0.0 110.829 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.739 ' CA ' HD12 ' A' ' 82' ' ' LEU . . . 140.78 -37.97 1.61 Allowed Glycine 0 N--CA 1.493 2.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.51 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -62.15 -28.18 69.47 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.931 -1.335 . . . . 0.0 111.022 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -51.42 -32.27 25.87 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.853 -1.154 . . . . 0.0 111.87 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -165.1 50.94 0.11 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.62 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.739 HD12 ' CA ' ' A' ' 78' ' ' GLY . 18.0 mt -118.31 -67.73 0.97 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.842 -1.162 . . . . 0.0 109.604 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.446 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 5.1 tp10 -121.0 127.81 52.12 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.143 -0.973 . . . . 0.0 109.815 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.4 -50.33 6.18 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.079 -1.013 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.49 -46.43 88.49 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.193 -0.942 . . . . 0.0 109.628 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -62.76 -36.92 84.63 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.438 -0.905 . . . . 0.0 109.722 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.885 ' HA ' HD12 ' A' ' 90' ' ' ILE . 19.6 ttpt -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.141 -0.974 . . . . 0.0 109.793 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.61 -41.73 97.87 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.18 -0.95 . . . . 0.0 109.558 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -61.01 -36.2 78.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.234 -0.916 . . . . 0.0 110.181 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.885 HD12 ' HA ' ' A' ' 87' ' ' LYS . 44.9 mt -60.11 -38.04 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.081 -1.012 . . . . 0.0 109.775 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -39.91 86.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 120.905 -1.122 . . . . 0.0 109.771 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -59.66 -38.38 81.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 109.737 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.554 ' ND1' HG22 ' A' ' 53' ' ' ILE . 20.7 m-70 -56.46 -47.18 79.71 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.157 -0.964 . . . . 0.0 110.137 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.481 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.9 mp -64.88 -39.75 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.182 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.38 -40.43 81.39 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.16 -0.962 . . . . 0.0 109.383 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -64.25 -40.17 95.46 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.251 -0.906 . . . . 0.0 109.515 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 97' ' ' LEU . 9.2 tp -71.09 -33.38 70.12 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.247 -0.908 . . . . 0.0 110.233 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 40.3 t -102.76 40.06 1.43 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.047 -1.033 . . . . 0.0 110.171 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 7.6 t . . . . . 0 N--CA 1.499 2.016 0 O-C-N 121.177 -0.952 . . . . 0.0 110.842 179.966 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -130.43 148.41 52.24 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.163 -0.961 . . . . 0.0 110.295 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.758 ' HB3' HD22 ' A' ' 76' ' ' LEU . 2.8 m-85 -114.09 153.48 29.4 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.316 -0.865 . . . . 0.0 110.25 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -135.69 124.68 24.24 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.438 -0.789 . . . . 0.0 109.318 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.822 HG12 HG23 ' A' ' 32' ' ' ILE . 20.5 m -101.16 134.57 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 O-C-N 121.222 -0.924 . . . . 0.0 110.736 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -143.89 108.4 4.85 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.558 ' CD2' HD13 ' A' ' 82' ' ' LEU . 11.6 m-85 -56.08 158.85 3.68 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.105 -0.997 . . . . 0.0 110.304 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.32 119.01 32.46 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.363 -0.836 . . . . 0.0 110.007 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -111.14 -53.11 2.74 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.165 -0.96 . . . . 0.0 110.39 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -139.93 96.5 3.07 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.184 -0.947 . . . . 0.0 110.191 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 143.45 122.33 1.66 Allowed Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.65 HG22 ' HA ' ' A' ' 26' ' ' VAL . 75.8 p -115.78 144.2 44.32 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.198 -1.178 . . . . 0.0 109.875 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -154.86 151.49 28.66 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.219 -0.926 . . . . 0.0 111.228 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.98 125.19 32.45 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 108.696 -1.761 . . . . 0.0 108.696 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.685 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 23.8 p -63.85 126.96 29.3 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.198 -1.178 . . . . 0.0 110.892 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.437 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 37.8 mmtt -74.89 156.27 36.57 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.601 -0.687 . . . . 0.0 109.178 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.46 15.54 10.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.938 -1.101 . . . . 0.0 111.601 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.685 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.6 p -174.88 150.39 1.25 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.515 -1.366 . . . . 0.0 110.767 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 89.64 7.88 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.043 -1.036 . . . . 0.0 111.668 -178.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.417 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.0 tt0 -167.02 -173.95 2.51 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.312 -0.867 . . . . 0.0 110.289 178.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -130.05 149.19 51.87 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.074 -1.016 . . . . 0.0 109.819 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.661 HG23 ' CG1' ' A' ' 29' ' ' VAL . 81.2 mt -101.24 120.74 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.194 -0.941 . . . . 0.0 109.711 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.65 ' HA ' HG22 ' A' ' 15' ' ' THR . 59.8 t -108.57 157.02 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.233 -0.917 . . . . 0.0 110.061 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.3 mtpp -51.39 126.73 17.89 Favored 'General case' 0 N--CA 1.514 2.747 0 O-C-N 121.273 -0.892 . . . . 0.0 110.704 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 104.3 9.67 35.71 Favored Glycine 0 N--CA 1.496 2.649 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.843 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.661 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.6 p -113.78 135.03 54.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.783 1.792 . . . . 0.0 110.436 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.448 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.3 p -78.36 133.77 37.53 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.193 -0.942 . . . . 0.0 109.903 179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.3 ptt-85 -132.24 140.33 48.62 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.157 -0.964 . . . . 0.0 110.18 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.822 HG23 HG12 ' A' ' 8' ' ' VAL . 9.9 mt -107.83 125.24 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.26 -0.9 . . . . 0.0 109.447 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.57 144.86 15.89 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.439 ' HB3' ' CE2' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -119.43 135.21 54.85 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.118 -1.225 . . . . 0.0 109.453 179.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.7 t -111.98 111.78 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.943 -1.098 . . . . 0.0 110.241 -179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.5 t -116.45 112.41 41.36 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.242 -0.912 . . . . 0.0 109.758 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.94 126.08 10.96 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 123.232 1.122 . . . . 0.0 110.503 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 . . . . . 0 N--CA 1.498 1.969 0 O-C-N 121.187 -0.946 . . . . 0.0 110.01 179.615 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.476 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -132.45 143.62 49.91 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.183 -1.187 . . . . 0.0 110.264 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.7 mmm -117.84 135.43 54.09 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.222 -0.923 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -116.77 143.87 45.14 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.258 -0.901 . . . . 0.0 109.713 179.563 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -132.09 137.75 47.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.088 -1.007 . . . . 0.0 110.459 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.419 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 25.8 m95 -94.05 117.19 29.76 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.087 -1.008 . . . . 0.0 110.82 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.523 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.92 172.38 10.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.032 -1.042 . . . . 0.0 109.689 177.679 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.485 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.1 m80 -88.96 -173.11 3.95 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.335 -0.853 . . . . 0.0 110.238 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.531 HG22 ' ND1' ' A' ' 93' ' ' HIS . 23.0 mm -86.13 -50.77 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -61.87 -38.47 88.39 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.097 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.1 m -61.78 -50.94 70.32 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.172 -0.955 . . . . 0.0 108.98 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.431 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -67.28 -45.42 76.67 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.465 -0.772 . . . . 0.0 109.655 179.796 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.67 -28.65 68.63 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 119.214 -0.995 . . . . 0.0 110.023 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.09 -42.43 76.18 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 120.896 -1.128 . . . . 0.0 108.894 178.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -74.97 -42.32 57.83 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.8 tp -62.39 -38.89 91.38 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.407 -0.808 . . . . 0.0 109.143 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -67.03 -32.73 74.14 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.183 -0.948 . . . . 0.0 110.131 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -102.42 16.37 26.47 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.046 -1.034 . . . . 0.0 111.699 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.812 0 O-C-N 120.668 -1.27 . . . . 0.0 110.131 179.727 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt . . . . . 0 N--CA 1.501 2.082 0 CA-C-O 120.808 0.337 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.1 mt 55.28 99.22 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.147 -0.971 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -110.2 134.6 52.06 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.264 -0.898 . . . . 0.0 109.685 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.47 -164.75 0.09 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.059 -1.026 . . . . 0.0 110.206 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.536 HD22 ' OG1' ' A' ' 91' ' ' THR . 25.9 tp -121.7 53.84 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.08 -1.012 . . . . 0.0 110.765 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.42 37.03 0.47 Allowed 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.175 -0.953 . . . . 0.0 110.755 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.47 ' O ' HD23 ' A' ' 76' ' ' LEU . 1.4 tm-20 -133.63 30.27 3.8 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.1 -1.0 . . . . 0.0 110.533 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.758 HD22 ' HB3' ' A' ' 6' ' ' PHE . 88.7 mt -134.08 154.68 51.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.015 -1.053 . . . . 0.0 109.722 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -86.2 104.01 15.35 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.194 -0.941 . . . . 0.0 110.502 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.407 ' HA3' HG23 ' A' ' 8' ' ' VAL . . . 148.2 -36.77 1.1 Allowed Glycine 0 N--CA 1.493 2.498 0 C-N-CA 119.766 -1.207 . . . . 0.0 110.893 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.459 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 17.3 p-90 -57.88 -35.23 70.7 Favored 'General case' 0 N--CA 1.509 2.511 0 CA-C-N 119.034 1.417 . . . . 0.0 110.838 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.459 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 1.9 tp10 -74.92 -29.38 60.95 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.021 -1.05 . . . . 0.0 110.862 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -99.01 -25.59 14.51 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.917 -1.114 . . . . 0.0 112.004 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.558 HD13 ' CD2' ' A' ' 10' ' ' TYR . 64.2 mt -76.21 -175.57 3.22 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.679 -1.263 . . . . 0.0 110.273 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -63.31 152.74 37.04 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.188 -0.945 . . . . 0.0 110.345 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -88.26 -40.18 13.85 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.189 -0.944 . . . . 0.0 110.22 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -60.17 -51.51 69.26 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.218 -0.926 . . . . 0.0 109.842 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.449 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 42.8 mt-10 -61.49 -40.0 92.99 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.254 -0.903 . . . . 0.0 109.326 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.666 ' HA ' HD12 ' A' ' 90' ' ' ILE . 1.2 tmmt? -59.56 -41.07 89.32 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.328 -0.857 . . . . 0.0 109.535 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -54.54 -33.6 60.37 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.209 -0.932 . . . . 0.0 110.364 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -57.63 -37.62 73.61 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.994 -1.066 . . . . 0.0 110.206 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.666 HD12 ' HA ' ' A' ' 87' ' ' LYS . 7.2 mt -62.36 -36.79 76.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.119 -0.988 . . . . 0.0 109.511 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.536 ' OG1' HD22 ' A' ' 73' ' ' LEU . 28.0 m -58.15 -38.13 76.01 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.899 -1.125 . . . . 0.0 109.6 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -57.79 -38.11 74.9 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.302 -0.874 . . . . 0.0 109.765 179.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.531 ' ND1' HG22 ' A' ' 53' ' ' ILE . 5.7 m-70 -58.56 -53.5 57.58 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -61.92 -38.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.396 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.95 92.67 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.176 -0.952 . . . . 0.0 109.774 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -60.94 -39.33 89.07 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.157 -0.964 . . . . 0.0 109.798 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.02 -34.58 68.94 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 110.349 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.5 t -101.07 62.84 0.98 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.025 -1.047 . . . . 0.0 110.197 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.1 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.144 -0.972 . . . . 0.0 110.223 -179.973 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.1 mtp85 -120.06 145.66 46.65 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.185 -0.947 . . . . 0.0 110.273 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.522 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.4 m-85 -125.37 142.38 51.53 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.301 -0.874 . . . . 0.0 110.133 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.3 t -125.66 157.51 37.09 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.239 -0.913 . . . . 0.0 109.938 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.405 HG12 ' CD1' ' A' ' 82' ' ' LEU . 52.0 t -113.31 116.72 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.121 -0.987 . . . . 0.0 110.03 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.442 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 3.9 t70 -123.72 148.44 46.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.143 -0.973 . . . . 0.0 110.113 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.719 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -105.3 142.48 34.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.273 -0.892 . . . . 0.0 109.646 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.66 126.94 29.72 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.123 -0.986 . . . . 0.0 110.355 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -137.85 109.28 6.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.299 -0.876 . . . . 0.0 110.143 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 37.69 41.56 0.32 Allowed 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.62 164.77 26.62 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.3 m -144.4 122.43 12.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.124 -1.221 . . . . 0.0 110.347 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -153.21 139.44 18.43 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.185 -0.947 . . . . 0.0 111.133 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.99 129.13 49.1 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.906 -1.677 . . . . 0.0 108.906 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 32.0 p -66.79 119.84 12.51 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.156 -1.202 . . . . 0.0 111.118 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 12.6 mmtp -68.25 159.41 31.3 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.271 -0.893 . . . . 0.0 109.192 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 tptt 63.59 19.38 11.68 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.524 -1.36 . . . . 0.0 110.757 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.848 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.5 p -177.47 153.42 0.91 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 120.575 -1.328 . . . . 0.0 110.716 178.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -91.83 86.71 5.99 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.011 -1.055 . . . . 0.0 111.65 -178.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -165.51 -172.52 2.46 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.278 -0.889 . . . . 0.0 110.516 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.9 ttpt -127.65 155.9 43.18 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.139 -0.976 . . . . 0.0 109.978 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.572 HD11 ' O ' ' A' ' 50' ' ' TRP . 70.5 mt -107.25 124.96 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.041 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 29' ' ' VAL . 34.1 m -130.29 156.13 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.233 -0.917 . . . . 0.0 110.144 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ttpt -48.96 129.22 17.14 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.336 -0.853 . . . . 0.0 110.855 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 116.83 -8.26 16.84 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.573 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.658 HG12 ' O ' ' A' ' 26' ' ' VAL . 7.3 p -125.09 134.85 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-N 119.795 1.797 . . . . 0.0 110.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 30.7 p -76.86 142.74 40.08 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.071 -1.018 . . . . 0.0 110.245 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.473 ' HD3' HG21 ' A' ' 25' ' ' ILE . 5.6 ptt180 -136.42 146.33 46.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.16 -0.962 . . . . 0.0 110.381 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.436 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 30.6 mt -113.81 132.69 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.287 -0.883 . . . . 0.0 109.902 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' O ' ' A' ' 49' ' ' GLU . . . -108.8 155.5 16.08 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.0 ttpm? -118.26 130.74 56.23 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.187 -1.184 . . . . 0.0 109.781 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.497 HG22 ' HB3' ' A' ' 48' ' ' LYS . 61.7 t -104.24 107.96 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.121 -0.987 . . . . 0.0 109.983 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.427 HG23 ' HD2' ' A' ' 37' ' ' PRO . 10.3 p -123.97 143.33 42.0 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.221 -0.925 . . . . 0.0 110.027 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.427 ' HD2' HG23 ' A' ' 36' ' ' VAL . 45.9 Cg_endo -72.12 146.91 47.42 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.228 1.12 . . . . 0.0 110.331 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 . . . . . 0 N--CA 1.5 2.071 0 O-C-N 121.288 -0.883 . . . . 0.0 110.241 179.863 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.475 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -117.0 131.63 56.91 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.221 -1.164 . . . . 0.0 110.127 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 tpt -117.31 151.66 36.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.096 -1.002 . . . . 0.0 110.423 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.497 ' HB3' HG22 ' A' ' 35' ' ' VAL . 18.8 pttt -131.3 141.93 50.03 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.271 -0.893 . . . . 0.0 110.163 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.424 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 80.3 mt-10 -120.08 164.58 15.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.0 109.757 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.572 ' O ' HD11 ' A' ' 25' ' ' ILE . 18.3 m95 -113.9 128.25 56.32 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.065 -1.022 . . . . 0.0 110.735 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.522 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 7.0 p90 -151.94 173.42 14.85 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.492 177.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.451 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 47.9 m80 -80.91 176.71 9.58 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.579 -0.701 . . . . 0.0 112.555 -176.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.493 HG23 ' CE2' ' A' ' 57' ' ' PHE . 21.1 mt -88.73 -53.95 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -54.72 -36.53 64.84 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.053 -1.029 . . . . 0.0 109.583 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 7.2 m -63.02 -51.68 65.86 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.313 -0.867 . . . . 0.0 109.15 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.539 ' O ' HD13 ' A' ' 60' ' ' LEU . 7.5 tpt -69.03 -42.35 76.49 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.736 -0.786 . . . . 0.0 109.459 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.493 ' CE2' HG23 ' A' ' 53' ' ' ILE . 12.8 m-85 -67.46 -30.57 70.32 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.981 179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.94 -40.79 62.82 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.859 -1.15 . . . . 0.0 109.059 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -58.66 -39.31 80.26 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.369 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 56' ' ' MET . 6.7 mp -53.59 -41.87 67.05 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.158 -0.964 . . . . 0.0 109.263 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.5 -36.08 75.37 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.257 -0.902 . . . . 0.0 109.5 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.18 33.2 4.41 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.229 -0.92 . . . . 0.0 110.345 179.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.093 0 O-C-N 120.981 -1.075 . . . . 0.0 110.499 -179.879 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.435 ' HB2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 120.899 0.381 . . . . 0.0 110.816 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.7 mt -89.52 124.0 42.01 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.255 -0.903 . . . . 0.0 109.877 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -116.36 148.25 40.8 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.263 -0.898 . . . . 0.0 110.188 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.14 177.34 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.079 -1.013 . . . . 0.0 110.683 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.752 HD13 ' CG2' ' A' ' 90' ' ' ILE . 61.5 tp -127.85 87.81 2.67 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.207 -0.933 . . . . 0.0 110.368 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.613 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -172.38 -51.35 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.199 -0.938 . . . . 0.0 110.84 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.87 -35.65 33.86 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 121.027 -1.046 . . . . 0.0 110.603 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.15 150.89 44.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.131 -0.981 . . . . 0.0 109.659 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -101.96 123.51 45.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.18 -0.95 . . . . 0.0 110.174 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 135.78 -36.86 1.97 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.47 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 43.0 p-90 -56.37 -37.37 69.97 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.939 -1.33 . . . . 0.0 110.685 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.47 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 2.9 tm-20 -71.87 -37.41 70.21 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.7 -29.14 69.07 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.184 -0.947 . . . . 0.0 111.037 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.719 HD13 ' CD2' ' A' ' 10' ' ' TYR . 85.0 mt -81.39 -173.77 4.55 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.851 -1.155 . . . . 0.0 110.262 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.54 162.36 12.96 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.204 -0.935 . . . . 0.0 110.469 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -86.6 -41.1 14.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.273 -0.892 . . . . 0.0 110.137 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -60.83 -47.62 85.53 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.267 -0.895 . . . . 0.0 109.435 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.431 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 17.6 mt-10 -60.61 -39.05 86.76 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.356 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.61 ' HG2' HD21 ' A' ' 73' ' ' LEU . 6.1 ttpt -56.17 -40.09 73.35 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.788 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.93 -36.07 69.79 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.218 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.58 -36.14 75.65 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.002 -1.061 . . . . 0.0 110.424 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.752 ' CG2' HD13 ' A' ' 73' ' ' LEU . 53.4 mt -65.26 -40.08 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.03 -1.044 . . . . 0.0 109.565 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -44.37 96.26 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.026 -1.046 . . . . 0.0 109.081 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -64.82 -39.63 93.89 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.489 ' NE2' HG22 ' A' ' 53' ' ' ILE . 16.8 t60 -57.08 -48.0 79.65 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.23 -0.919 . . . . 0.0 109.742 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.429 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 11.6 mt -65.09 -38.49 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.281 -0.967 . . . . 0.0 109.132 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.12 84.79 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.189 -0.944 . . . . 0.0 109.666 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.05 -37.38 82.42 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.236 -0.915 . . . . 0.0 110.002 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.476 HD22 ' HD1' ' A' ' 57' ' ' PHE . 19.6 tp -81.42 -38.27 26.76 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.061 -1.024 . . . . 0.0 110.112 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 30.4 t -74.61 -38.25 62.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.496 1.87 0 O-C-N 121.136 -0.977 . . . . 0.0 110.03 179.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 . . . . . 0 N--CA 1.494 1.764 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.55 139.51 52.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.16 -0.962 . . . . 0.0 110.143 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.505 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.9 m-85 -119.74 154.66 33.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.182 -0.948 . . . . 0.0 110.326 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -143.76 134.29 24.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.318 -0.864 . . . . 0.0 110.298 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.783 HG23 HD23 ' A' ' 76' ' ' LEU . 47.7 t -102.5 105.76 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.223 -0.923 . . . . 0.0 109.671 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -118.02 159.45 23.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.14 -0.975 . . . . 0.0 110.874 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.73 149.1 27.65 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.545 -0.722 . . . . 0.0 109.637 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.43 123.74 27.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.173 -0.954 . . . . 0.0 109.953 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -149.65 39.36 0.79 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.183 -0.948 . . . . 0.0 110.588 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -136.38 -66.03 0.55 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.215 -0.928 . . . . 0.0 110.156 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.69 -137.67 2.52 Favored Glycine 0 N--CA 1.497 2.745 0 N-CA-C 110.064 -1.215 . . . . 0.0 110.064 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.946 HG22 HG12 ' A' ' 26' ' ' VAL . 70.3 p -122.78 116.22 23.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.231 -1.158 . . . . 0.0 110.038 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 134.67 54.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.131 -0.981 . . . . 0.0 110.653 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.27 123.12 31.55 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 108.527 -1.829 . . . . 0.0 108.527 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.737 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 26.3 p -64.59 129.09 38.5 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.29 -1.123 . . . . 0.0 110.914 -178.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 35.5 mmtt -75.45 156.02 35.7 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.578 -0.701 . . . . 0.0 109.251 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 65.76 15.82 10.22 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.85 -1.156 . . . . 0.0 111.704 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.737 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.8 p -174.91 151.27 1.35 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.557 -1.339 . . . . 0.0 110.752 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -87.1 90.73 8.46 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.053 -1.029 . . . . 0.0 111.647 -177.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.436 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 0.4 OUTLIER -167.62 -174.0 2.35 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.332 -0.855 . . . . 0.0 110.412 178.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -126.08 154.03 43.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.989 -1.07 . . . . 0.0 110.036 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.556 HD13 ' HD3' ' A' ' 31' ' ' ARG . 80.4 mt -109.86 103.09 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.404 -0.81 . . . . 0.0 109.912 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.946 HG12 HG22 ' A' ' 15' ' ' THR . 22.9 m -110.98 162.98 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.259 -0.901 . . . . 0.0 110.397 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -49.6 137.27 15.73 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.415 -0.803 . . . . 0.0 111.033 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.36 50.74 Favored Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.184 -1.007 . . . . 0.0 111.499 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.1 p -126.86 137.36 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.73 1.765 . . . . 0.0 110.786 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.495 ' SG ' HD21 ' A' ' 82' ' ' LEU . 42.3 t -93.49 138.98 31.25 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.237 -0.914 . . . . 0.0 109.774 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.1 ptt180 -135.09 147.78 49.64 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.258 -0.901 . . . . 0.0 110.348 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.436 HG22 ' HD1' ' A' ' 6' ' ' PHE . 15.1 mt -106.33 123.83 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.313 -0.867 . . . . 0.0 109.523 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.24 137.22 13.32 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.458 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 37.4 ttpt -107.26 124.2 49.42 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.233 -1.157 . . . . 0.0 109.379 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.4 t -99.98 114.45 38.48 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.069 -1.019 . . . . 0.0 110.321 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.2 p -121.82 138.18 28.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.292 -0.88 . . . . 0.0 110.345 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.2 151.28 34.1 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 O-C-N 123.003 1.002 . . . . 0.0 110.458 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 . . . . . 0 N--CA 1.5 2.025 0 O-C-N 121.298 -0.876 . . . . 0.0 110.088 179.748 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.528 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.76 143.83 44.44 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.255 -1.144 . . . . 0.0 109.986 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 mmt -116.82 139.08 51.02 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.172 -0.955 . . . . 0.0 110.285 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 6.1 ttmm -129.37 130.64 46.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.276 -0.89 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -114.68 138.74 50.34 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.204 -0.935 . . . . 0.0 109.82 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 11.5 m95 -93.98 112.76 24.63 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.191 -0.943 . . . . 0.0 110.852 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.505 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 0.7 OUTLIER -123.54 170.93 9.92 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.47 177.064 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.0 m80 -88.97 -173.88 4.25 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.442 -0.786 . . . . 0.0 110.338 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.558 HG22 ' CE1' ' A' ' 93' ' ' HIS . 34.7 mm -83.22 -54.61 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 tttp -60.07 -37.5 80.05 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.292 -0.88 . . . . 0.0 109.398 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.4 m -60.75 -51.22 70.28 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.208 -0.932 . . . . 0.0 109.14 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 11.3 tpt -69.21 -45.43 69.87 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.365 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 11.2 m-85 -63.21 -29.88 71.13 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.833 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -62.84 -41.55 99.39 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.885 -1.134 . . . . 0.0 109.122 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -40.88 92.11 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.226 -0.921 . . . . 0.0 108.927 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -55.78 -41.71 74.49 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.139 -0.976 . . . . 0.0 109.237 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.26 -35.45 71.76 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.314 -0.866 . . . . 0.0 109.581 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.7 mmt85 -105.97 31.16 5.27 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.196 -0.94 . . . . 0.0 110.544 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.853 0 O-C-N 120.987 -1.071 . . . . 0.0 110.086 179.939 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.776 0.322 . . . . 0.0 110.284 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.3 mt 54.21 99.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.08 -1.013 . . . . 0.0 110.782 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -107.43 139.18 42.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.188 -0.945 . . . . 0.0 109.403 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.62 -163.99 0.12 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.964 -1.085 . . . . 0.0 110.053 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.648 HD21 ' HG3' ' A' ' 87' ' ' LYS . 56.4 tp -116.08 70.84 0.76 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.034 -1.041 . . . . 0.0 110.473 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.68 -163.7 0.34 Allowed 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.229 -0.92 . . . . 0.0 110.314 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 54.44 37.45 27.76 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.996 -1.065 . . . . 0.0 110.259 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.783 HD23 HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -145.22 151.53 38.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.197 -0.94 . . . . 0.0 109.74 -179.774 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -94.49 97.18 9.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.123 -0.985 . . . . 0.0 109.99 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.12 -36.56 0.95 Allowed Glycine 0 N--CA 1.495 2.627 0 C-N-CA 119.72 -1.229 . . . . 0.0 110.752 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 52.8 p-90 -56.01 -34.78 66.14 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.921 1.36 . . . . 0.0 110.616 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.41 -43.81 96.42 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.052 -1.03 . . . . 0.0 109.439 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -60.45 -39.75 88.68 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.14 -0.975 . . . . 0.0 109.75 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.551 ' CD2' HD11 ' A' ' 90' ' ' ILE . 3.5 mp -49.38 173.56 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.907 0 O-C-N 121.219 -0.926 . . . . 0.0 110.643 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -101.23 161.0 13.93 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.069 -1.019 . . . . 0.0 110.383 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -55.59 -36.18 66.61 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.181 -0.949 . . . . 0.0 110.967 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -70.41 -43.48 69.9 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.063 -1.023 . . . . 0.0 109.452 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.41 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 22.2 mt-10 -70.64 -39.35 73.71 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.839 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.648 ' HG3' HD21 ' A' ' 73' ' ' LEU . 26.0 tttt -61.81 -37.43 84.38 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.286 -0.884 . . . . 0.0 109.853 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -65.91 -40.25 91.32 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.149 -0.969 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.33 79.72 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.241 -0.912 . . . . 0.0 110.538 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.6 HG22 HD13 ' A' ' 73' ' ' LEU . 98.5 mt -68.19 -36.99 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 O-C-N 121.113 -0.992 . . . . 0.0 109.434 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.43 -38.92 88.89 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.886 -1.134 . . . . 0.0 109.451 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -57.39 -37.96 73.51 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.164 -0.96 . . . . 0.0 109.874 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.558 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.7 m-70 -55.01 -47.8 74.2 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.116 -0.99 . . . . 0.0 110.066 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mp -66.0 -38.89 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.238 -0.914 . . . . 0.0 109.197 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.26 79.21 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.186 -0.946 . . . . 0.0 109.696 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.8 -36.97 85.01 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.168 -0.958 . . . . 0.0 109.903 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.2 tp -82.31 -30.9 30.24 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.066 -1.021 . . . . 0.0 110.646 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.8 t -101.26 55.78 0.84 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.869 -1.145 . . . . 0.0 110.263 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 p . . . . . 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.015 . . . . 0.0 110.247 179.779 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.76 126.18 51.98 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.233 -0.917 . . . . 0.0 110.177 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.822 ' HB3' HD11 ' A' ' 76' ' ' LEU . 1.5 m-85 -116.18 143.95 44.82 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.171 -0.956 . . . . 0.0 110.059 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.5 p -141.03 138.32 33.58 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.237 -0.914 . . . . 0.0 109.877 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.76 HG13 ' CD2' ' A' ' 76' ' ' LEU . 21.7 m -104.53 140.5 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.093 -1.004 . . . . 0.0 110.222 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -142.28 156.05 45.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.245 -0.909 . . . . 0.0 110.335 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -107.35 154.07 21.83 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.359 -0.838 . . . . 0.0 109.792 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.532 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . . . -82.33 142.27 32.18 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.243 -0.911 . . . . 0.0 110.058 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -143.51 -59.86 0.41 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.292 -0.88 . . . . 0.0 110.163 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.62 84.57 2.25 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.251 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.34 174.82 14.51 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.543 HG22 HG12 ' A' ' 26' ' ' VAL . 55.3 p -140.68 139.18 34.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.184 -1.186 . . . . 0.0 110.204 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -123.42 150.77 43.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.214 -0.929 . . . . 0.0 110.677 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.08 120.13 5.22 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.6 t -64.71 122.52 17.07 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.262 -1.14 . . . . 0.0 109.732 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.83 148.05 44.52 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.057 -1.027 . . . . 0.0 108.669 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp 53.0 64.93 1.67 Allowed 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.906 -1.121 . . . . 0.0 108.949 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -172.94 -43.65 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.221 -0.924 . . . . 0.0 112.555 -177.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tttm 70.06 44.85 0.75 Allowed 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.884 -1.135 . . . . 0.0 108.202 -177.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.72 -168.38 2.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.556 -0.715 . . . . 0.0 109.49 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -137.22 157.5 46.52 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.984 -1.073 . . . . 0.0 110.42 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.591 HG23 HG13 ' A' ' 29' ' ' VAL . 69.5 mt -110.95 110.28 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.402 -0.811 . . . . 0.0 109.826 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.798 ' O ' HG12 ' A' ' 29' ' ' VAL . 24.4 m -110.11 169.39 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 O-C-N 121.187 -0.946 . . . . 0.0 110.614 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HA ' ' HB3' ' A' ' 11' ' ' ALA . 35.8 tttt -46.6 138.61 5.8 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 121.56 -0.712 . . . . 0.0 111.136 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 107.57 -23.16 27.02 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.968 -1.11 . . . . 0.0 110.533 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.798 HG12 ' O ' ' A' ' 26' ' ' VAL . 14.8 p -113.52 137.59 46.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-N 119.151 1.475 . . . . 0.0 110.318 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.655 ' HB3' HD11 ' A' ' 53' ' ' ILE . 44.8 t -91.17 142.43 27.75 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.045 -1.035 . . . . 0.0 110.199 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.449 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 1.1 ptt180 -128.16 153.3 47.03 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.143 -0.973 . . . . 0.0 110.533 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.413 HD12 ' HG2' ' A' ' 56' ' ' MET . 11.4 mt -111.95 137.26 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.344 -0.847 . . . . 0.0 110.414 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.414 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.09 129.2 9.58 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 108.348 -1.901 . . . . 0.0 108.348 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.45 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 33.6 ttpt -110.15 116.96 32.47 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.069 -1.253 . . . . 0.0 110.395 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.6 t -109.24 109.4 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.222 -0.924 . . . . 0.0 110.017 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.3 t -120.53 112.57 34.03 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.215 -0.928 . . . . 0.0 109.961 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.3 133.75 19.82 Favored 'Trans proline' 0 C--N 1.32 -0.941 0 O-C-N 123.119 1.063 . . . . 0.0 110.393 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 61.1 t30 . . . . . 0 N--CA 1.5 2.049 0 O-C-N 121.203 -0.935 . . . . 0.0 110.028 179.719 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.48 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -133.33 147.41 51.84 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.167 -1.196 . . . . 0.0 110.331 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.7 mtt -115.27 143.58 45.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.167 -0.958 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -118.6 123.88 46.08 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.225 -0.922 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -116.66 137.21 52.36 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.181 -0.949 . . . . 0.0 109.897 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 26.7 m95 -92.84 134.48 35.04 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.219 -0.925 . . . . 0.0 109.998 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -121.71 176.01 5.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.255 -0.903 . . . . 0.0 110.739 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.4 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 2.6 m80 -96.69 -172.36 2.47 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.876 HG22 ' CE1' ' A' ' 93' ' ' HIS . 39.8 mm -84.74 -37.14 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.998 -1.064 . . . . 0.0 109.275 178.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.45 -27.26 20.49 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.74 -1.225 . . . . 0.0 111.213 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 83.3 m -70.46 -46.49 63.7 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.819 -1.176 . . . . 0.0 110.435 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.413 ' HG2' HD12 ' A' ' 32' ' ' ILE . 9.7 tpt -68.8 -38.52 80.0 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.323 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.455 ' CE1' HG13 ' A' ' 94' ' ' ILE . 9.3 m-85 -75.05 -31.43 61.3 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.803 -1.159 . . . . 0.0 109.578 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -62.51 -36.21 81.82 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.026 -1.047 . . . . 0.0 109.524 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -60.24 -40.16 89.28 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.093 -1.005 . . . . 0.0 109.758 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.781 ' HB3' HD21 ' A' ' 97' ' ' LEU . 10.1 mp -60.96 -42.33 98.08 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.975 . . . . 0.0 109.154 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.4 ' N ' HD11 ' A' ' 97' ' ' LEU . 6.9 tt0 -56.08 -33.68 65.27 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.205 -0.935 . . . . 0.0 109.674 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 33.4 mtm-85 -102.63 29.59 5.21 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.279 -0.888 . . . . 0.0 110.449 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.808 0 O-C-N 120.905 -1.122 . . . . 0.0 109.902 179.742 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.402 ' O ' HD21 ' A' ' 60' ' ' LEU . 13.3 mtmt . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 120.699 0.285 . . . . 0.0 110.402 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.2 mt 54.77 101.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.2 -0.937 . . . . 0.0 110.821 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -110.92 143.32 41.73 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.068 -1.02 . . . . 0.0 109.892 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.58 -170.75 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.039 -1.038 . . . . 0.0 110.477 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.709 HD21 ' CG ' ' A' ' 87' ' ' LYS . 2.8 tp -111.37 43.4 1.5 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.146 -0.971 . . . . 0.0 110.105 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.9 -168.9 3.24 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.141 -0.974 . . . . 0.0 110.051 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 55.42 38.11 29.83 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.905 -1.122 . . . . 0.0 109.935 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.822 HD11 ' HB3' ' A' ' 6' ' ' PHE . 1.5 tp -144.65 150.44 37.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.348 -0.845 . . . . 0.0 109.48 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -93.78 104.45 16.53 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.061 -1.024 . . . . 0.0 110.464 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.412 ' HA3' HG22 ' A' ' 8' ' ' VAL . . . 150.02 -45.26 0.68 Allowed Glycine 0 N--CA 1.494 2.514 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.762 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 34.0 p-90 -58.72 -35.51 72.79 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.004 -1.292 . . . . 0.0 110.614 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -56.17 -34.4 66.14 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.921 -1.112 . . . . 0.0 110.699 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -83.58 -34.87 25.08 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.953 -1.092 . . . . 0.0 110.722 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.651 ' CD2' HD11 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -49.77 175.1 0.01 OUTLIER 'General case' 0 N--CA 1.518 2.93 0 O-C-N 121.067 -1.02 . . . . 0.0 110.941 -179.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.76 161.61 13.53 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.312 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.59 -45.3 89.41 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.976 . . . . 0.0 110.41 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -61.52 -51.75 67.32 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.533 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.65 -39.33 94.09 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.111 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.763 ' HA ' HD12 ' A' ' 90' ' ' ILE . 19.9 ttpp -59.96 -38.75 83.39 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.305 -0.872 . . . . 0.0 109.709 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -60.32 -39.35 86.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.15 -0.969 . . . . 0.0 109.861 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.84 -40.95 90.25 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.14 -0.975 . . . . 0.0 110.1 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 87' ' ' LYS . 10.4 mt -62.28 -40.19 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 O-C-N 121.205 -0.934 . . . . 0.0 109.524 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.9 m -58.15 -39.62 79.25 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.04 -1.037 . . . . 0.0 109.921 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.8 -39.27 80.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.227 -0.92 . . . . 0.0 109.627 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.876 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.3 m-70 -60.01 -52.04 67.08 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.253 -0.904 . . . . 0.0 109.778 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.455 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.6 mt -62.68 -39.08 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.383 -0.927 . . . . 0.0 109.444 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.72 94.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.187 -0.946 . . . . 0.0 109.47 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.7 -39.7 66.78 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.229 -0.919 . . . . 0.0 109.11 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.781 HD21 ' HB3' ' A' ' 60' ' ' LEU . 21.6 tp -68.5 -32.58 72.66 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.267 -0.896 . . . . 0.0 110.363 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 16.3 t -92.81 -40.63 10.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.925 -1.109 . . . . 0.0 110.177 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.493 1.723 0 O-C-N 121.143 -0.973 . . . . 0.0 110.147 179.915 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.503 2.184 0 CA-C-O 120.948 0.404 . . . . 0.0 110.491 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -124.01 129.98 51.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.147 -0.971 . . . . 0.0 110.167 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.4 m-85 -124.02 137.44 54.59 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.158 -0.964 . . . . 0.0 110.086 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.2 t -126.77 147.87 49.96 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 109.628 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.888 ' CG1' HD23 ' A' ' 76' ' ' LEU . 27.2 m -116.18 139.63 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 121.057 -1.027 . . . . 0.0 110.604 179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -147.5 162.73 38.47 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.24 -0.913 . . . . 0.0 110.399 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.706 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.6 OUTLIER -110.29 141.55 43.12 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.368 -0.832 . . . . 0.0 109.814 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.439 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -63.93 134.06 54.4 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.744 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -140.62 -65.68 0.45 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.209 -0.932 . . . . 0.0 110.465 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -121.97 85.33 2.39 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.176 -0.953 . . . . 0.0 110.228 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 126.92 159.36 10.16 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -132.48 149.64 52.3 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.212 -1.169 . . . . 0.0 110.086 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.06 145.85 50.58 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.168 -0.958 . . . . 0.0 110.557 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.43 118.63 7.97 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.9 t -63.85 123.28 18.52 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.191 -1.182 . . . . 0.0 109.695 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HB2' ' CE2' ' A' ' 51' ' ' TYR . 0.8 OUTLIER -61.61 147.86 44.33 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.08 -1.013 . . . . 0.0 108.664 179.176 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt 53.09 64.66 1.78 Allowed 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.979 -1.076 . . . . 0.0 108.815 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -173.04 -43.58 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.249 -0.907 . . . . 0.0 112.583 -177.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt 69.06 44.15 1.04 Allowed 'General case' 0 N--CA 1.505 2.295 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -177.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 -168.71 2.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.564 -0.71 . . . . 0.0 109.437 -179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -140.1 158.67 43.69 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.017 -1.052 . . . . 0.0 110.193 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.644 HG23 ' CG2' ' A' ' 29' ' ' VAL . 50.8 mt -102.89 118.12 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.505 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.3 t -107.76 160.25 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.162 -0.961 . . . . 0.0 110.352 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -48.49 121.7 4.74 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 121.444 -0.785 . . . . 0.0 111.15 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.68 -25.93 5.24 Favored Glycine 0 N--CA 1.493 2.448 0 C-N-CA 119.999 -1.096 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.644 ' CG2' HG23 ' A' ' 25' ' ' ILE . 6.6 m -104.38 137.61 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 CA-C-N 119.148 1.474 . . . . 0.0 110.488 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.919 ' HB3' HD11 ' A' ' 53' ' ' ILE . 1.3 t -81.06 134.99 35.76 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.192 -0.942 . . . . 0.0 109.647 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.432 ' CB ' HD13 ' A' ' 25' ' ' ILE . 12.0 ptt-85 -122.43 149.03 44.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.201 -0.937 . . . . 0.0 110.402 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.1 mt -108.35 139.87 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.315 -0.865 . . . . 0.0 110.603 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.03 122.38 6.9 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 41.0 tttt -105.97 120.07 40.83 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.101 -1.235 . . . . 0.0 110.082 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.429 HG12 ' CB ' ' A' ' 46' ' ' ASP . 62.1 t -103.5 107.17 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.25 -0.906 . . . . 0.0 110.22 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.7 t -122.31 138.31 28.89 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 109.615 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.92 131.89 16.24 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.262 1.138 . . . . 0.0 110.22 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 . . . . . 0 N--CA 1.499 1.999 0 O-C-N 121.102 -0.999 . . . . 0.0 110.166 179.883 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.443 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.429 ' CB ' HG12 ' A' ' 35' ' ' VAL . 0.9 OUTLIER -116.74 158.09 24.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.166 -1.196 . . . . 0.0 110.245 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttt -101.72 144.16 30.76 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.363 -0.836 . . . . 0.0 110.119 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HE3' ' CZ2' ' A' ' 50' ' ' TRP . 26.9 ttpt -116.53 123.01 46.37 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.327 -0.858 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -115.26 140.36 49.17 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.346 -0.846 . . . . 0.0 109.712 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.452 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 57.0 m95 -97.83 128.14 44.26 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.137 -0.977 . . . . 0.0 110.167 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 19' ' ' LYS . 97.4 m-85 -115.81 174.64 5.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.344 -0.847 . . . . 0.0 110.855 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.8 m80 -91.28 -171.43 2.95 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.98 HG22 ' CE1' ' A' ' 93' ' ' HIS . 46.6 mm -83.49 -39.9 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.879 -1.138 . . . . 0.0 109.722 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -85.06 -32.26 22.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 120.83 -1.169 . . . . 0.0 111.058 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 71.2 m -62.68 -52.89 61.51 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.994 -1.066 . . . . 0.0 110.4 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -40.39 88.02 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.012 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.673 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 9.6 m-85 -70.97 -30.43 66.7 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 119.08 -1.048 . . . . 0.0 109.634 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -61.35 -36.86 81.35 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.598 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.14 88.58 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.024 -1.048 . . . . 0.0 109.804 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 69' ' ' LYS . 10.2 mp -63.05 -44.42 95.92 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.429 -0.909 . . . . 0.0 108.969 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.38 -33.62 68.01 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.218 -0.926 . . . . 0.0 109.695 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.65 29.33 5.82 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.277 -0.889 . . . . 0.0 110.576 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.753 0 O-C-N 120.888 -1.133 . . . . 0.0 110.042 179.841 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.536 ' O ' HD21 ' A' ' 60' ' ' LEU . 17.2 mtpp . . . . . 0 N--CA 1.494 1.771 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.4 mt 54.54 99.34 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.213 -0.929 . . . . 0.0 110.704 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -112.7 135.25 53.66 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 0.0 109.978 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.0 -173.52 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.039 -1.038 . . . . 0.0 110.547 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.697 ' O ' HG23 ' A' ' 74' ' ' THR . 49.8 tp -113.71 83.26 1.82 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.162 -0.961 . . . . 0.0 110.22 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -170.0 -51.62 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.161 -0.962 . . . . 0.0 111.056 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -49.38 -36.32 21.43 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.113 -0.992 . . . . 0.0 110.796 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.888 HD23 ' CG1' ' A' ' 8' ' ' VAL . 6.3 mp -72.74 150.43 42.87 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.189 -0.944 . . . . 0.0 109.367 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.524 ' O ' HG22 ' A' ' 8' ' ' VAL . 12.9 mm-40 -97.77 136.74 37.68 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.249 -0.907 . . . . 0.0 111.251 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.53 -41.63 1.52 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.46 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 52.9 p-90 -53.96 -35.65 62.01 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.993 -1.298 . . . . 0.0 110.868 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.46 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 15.8 tt0 -68.11 -28.93 67.76 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.111 -0.993 . . . . 0.0 111.035 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -96.38 -34.52 11.51 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 120.826 -1.171 . . . . 0.0 111.251 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.706 HD13 ' CD2' ' A' ' 10' ' ' TYR . 74.4 mt -59.25 -175.3 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.865 -1.147 . . . . 0.0 110.151 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.33 161.63 11.21 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.154 -0.966 . . . . 0.0 110.26 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.2 -45.43 11.33 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.217 -0.927 . . . . 0.0 109.925 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -62.6 -42.45 99.58 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.315 -0.866 . . . . 0.0 109.396 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.422 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 1.1 mp0 -61.57 -40.28 94.16 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.338 -0.851 . . . . 0.0 109.514 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.521 ' CG ' HD21 ' A' ' 73' ' ' LEU . 22.2 ttpt -57.66 -39.57 77.33 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.322 -0.861 . . . . 0.0 109.943 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -60.41 -42.23 95.53 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.206 -0.933 . . . . 0.0 109.637 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -59.81 -35.37 74.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.324 -0.86 . . . . 0.0 110.237 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.568 ' CG2' HD13 ' A' ' 73' ' ' LEU . 37.9 mm -60.33 -38.93 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.492 0 O-C-N 121.109 -0.994 . . . . 0.0 109.634 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 m -58.59 -42.53 88.29 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.02 -1.05 . . . . 0.0 109.795 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -63.35 -40.64 97.84 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.297 -0.877 . . . . 0.0 109.284 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.98 ' CE1' HG22 ' A' ' 53' ' ' ILE . 67.6 t60 -58.39 -41.8 85.7 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.192 -0.942 . . . . 0.0 109.59 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.441 ' CG1' ' CZ ' ' A' ' 57' ' ' PHE . 9.3 mt -69.75 -39.62 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.176 -0.952 . . . . 0.0 108.9 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.89 -38.05 84.32 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.211 -0.931 . . . . 0.0 109.728 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -63.62 -41.48 98.27 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.134 -0.978 . . . . 0.0 109.488 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.446 HD21 ' HB3' ' A' ' 60' ' ' LEU . 5.9 tp -60.7 -35.58 76.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.243 -0.911 . . . . 0.0 110.33 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.1 t -89.93 -39.29 13.1 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.05 -1.031 . . . . 0.0 110.178 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 41.8 t . . . . . 0 N--CA 1.495 1.8 0 O-C-N 121.183 -0.948 . . . . 0.0 110.099 179.868 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 110.231 -0.285 . . . . 0.0 110.231 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -141.47 125.43 17.17 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.915 . . . . 0.0 110.288 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.443 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 0.9 OUTLIER -117.05 141.56 48.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.17 -0.956 . . . . 0.0 110.052 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' O ' HG23 ' A' ' 32' ' ' ILE . 80.5 m -127.74 156.39 42.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 109.803 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.415 HG23 ' HB3' ' A' ' 76' ' ' LEU . 59.6 t -111.2 120.58 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.128 -0.982 . . . . 0.0 109.927 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -137.95 156.45 47.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.136 -0.978 . . . . 0.0 110.605 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -101.45 154.1 19.11 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.485 -0.76 . . . . 0.0 109.693 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.27 140.76 29.38 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.246 -0.909 . . . . 0.0 110.34 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 tttp -136.03 -58.11 0.76 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.279 -0.888 . . . . 0.0 110.456 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -134.34 99.14 4.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.075 . . . . 0.0 110.316 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.6 138.65 3.35 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 26' ' ' VAL . 76.6 p -124.54 146.35 49.06 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.189 -1.183 . . . . 0.0 109.942 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -163.35 153.93 16.16 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.18 -0.95 . . . . 0.0 111.435 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.77 120.13 8.66 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.475 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 24.5 p -58.92 140.29 55.64 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.184 -1.186 . . . . 0.0 110.21 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 8.0 tptt -94.19 150.73 20.04 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.114 -0.991 . . . . 0.0 110.581 -178.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 13.2 mptt 51.6 48.39 22.97 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.475 ' HB3' ' SG ' ' A' ' 18' ' ' CYS 0.263 10.4 t -165.2 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.861 -0.524 . . . . 0.0 110.485 -175.481 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 21' ' ' CYS . 23.5 tttt 78.12 74.22 0.06 Allowed 'General case' 0 N--CA 1.526 3.342 0 O-C-N 120.947 -1.096 . . . . 0.0 112.492 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.4 tt0 -176.11 -172.88 0.53 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.165 -0.959 . . . . 0.0 110.604 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -120.3 146.16 46.38 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.112 -0.992 . . . . 0.0 109.142 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.9 mt -107.11 141.82 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.058 -1.026 . . . . 0.0 110.477 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.555 ' HA ' HG22 ' A' ' 15' ' ' THR . 59.4 t -141.12 158.04 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.249 -0.907 . . . . 0.0 109.961 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.54 135.97 17.43 Favored 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.287 -0.883 . . . . 0.0 111.089 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.56 8.72 39.81 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.155 -1.021 . . . . 0.0 111.828 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.8 p -127.45 132.79 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-N 119.853 1.827 . . . . 0.0 110.855 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 20.2 t -73.19 143.3 47.25 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.22 -0.925 . . . . 0.0 108.855 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.428 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 11.9 ptt180 -145.47 155.38 43.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.123 -0.986 . . . . 0.0 111.475 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.527 HG23 ' O ' ' A' ' 7' ' ' CYS . 3.8 mt -105.08 145.09 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.449 -0.782 . . . . 0.0 109.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.83 137.69 13.91 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 108.413 -1.875 . . . . 0.0 108.413 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.443 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 19.4 ttpt -117.94 123.75 46.55 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.903 -1.351 . . . . 0.0 110.42 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -96.44 113.09 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.229 -0.919 . . . . 0.0 110.115 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.9 t -120.49 119.13 30.6 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.267 -0.896 . . . . 0.0 109.916 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.35 145.66 38.73 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 O-C-N 123.132 1.07 . . . . 0.0 110.342 179.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.7 t30 . . . . . 0 N--CA 1.5 2.039 0 O-C-N 121.149 -0.97 . . . . 0.0 110.151 179.874 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.436 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -144.22 136.61 26.66 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -1.207 . . . . 0.0 110.268 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ttt -117.04 142.95 46.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.275 -0.891 . . . . 0.0 110.34 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -125.25 120.74 32.09 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.278 -0.889 . . . . 0.0 110.26 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -117.98 149.46 40.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.254 -0.904 . . . . 0.0 109.221 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.428 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 16.9 m95 -91.62 163.2 14.2 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.105 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.447 ' OH ' ' HB2' ' A' ' 20' ' ' LYS . 34.0 m-85 -140.39 173.91 11.04 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.38 -0.825 . . . . 0.0 110.841 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.439 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 11.1 m80 -108.77 -176.92 3.17 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.361 -0.837 . . . . 0.0 109.52 177.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 1.009 HG22 ' CE1' ' A' ' 93' ' ' HIS . 48.7 mm -97.48 -60.45 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -80.1 -43.14 22.25 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.782 -1.199 . . . . 0.0 109.388 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.439 ' HB3' ' CB ' ' A' ' 52' ' ' HIS . 19.3 t -63.12 -27.99 69.76 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.71 178.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -83.2 -54.34 5.09 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.725 -1.234 . . . . 0.0 108.648 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.576 ' HD2' HD22 ' A' ' 97' ' ' LEU . 13.0 m-85 -59.61 -26.55 65.56 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.72 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.71 -38.98 86.89 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.833 -1.167 . . . . 0.0 109.375 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.5 tttm -67.96 -40.65 83.17 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.281 178.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.75 -41.76 96.06 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.239 -0.913 . . . . 0.0 109.081 179.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' A' ' 97' ' ' LEU . 8.4 tt0 -56.17 -33.41 65.22 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.245 -0.909 . . . . 0.0 109.695 178.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.3 mtp-105 -103.68 29.87 5.46 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.316 -0.865 . . . . 0.0 110.573 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.84 0 O-C-N 120.948 -1.095 . . . . 0.0 110.026 179.852 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.7 mtpt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 110.183 -0.302 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.3 97.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.174 -0.953 . . . . 0.0 110.642 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -114.79 136.2 53.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.147 -0.97 . . . . 0.0 110.333 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.67 -178.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.043 -1.036 . . . . 0.0 110.919 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.787 HD13 ' CG2' ' A' ' 90' ' ' ILE . 62.3 tp -114.4 81.22 1.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.291 -0.881 . . . . 0.0 110.374 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.507 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -172.17 -51.63 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 110.722 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -51.19 -36.77 43.0 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.11 -0.994 . . . . 0.0 110.425 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' A' ' 6' ' ' PHE . 1.4 mp -63.46 152.33 38.68 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.136 -0.978 . . . . 0.0 109.451 179.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -102.1 116.29 32.36 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.187 -0.946 . . . . 0.0 110.307 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.08 -36.12 1.77 Allowed Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.909 -1.139 . . . . 0.0 110.467 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -51.53 -32.24 27.12 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.894 -1.357 . . . . 0.0 111.021 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -56.7 -39.87 74.63 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.907 -1.121 . . . . 0.0 110.126 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.61 -41.16 93.04 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.169 -0.957 . . . . 0.0 109.629 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.61 ' CD2' HD11 ' A' ' 90' ' ' ILE . 3.8 mp -47.67 165.55 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.913 0 O-C-N 121.291 -0.881 . . . . 0.0 110.875 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -88.47 161.37 17.05 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.226 -0.921 . . . . 0.0 109.823 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -56.32 -38.27 71.09 Favored 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.15 -0.968 . . . . 0.0 110.687 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -71.89 -40.42 68.91 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.182 -0.949 . . . . 0.0 109.707 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.4 -36.16 65.97 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.222 -0.924 . . . . 0.0 109.346 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.495 ' HG2' HD21 ' A' ' 73' ' ' LEU . 12.7 tttm -69.56 -37.67 77.12 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.117 -0.989 . . . . 0.0 109.625 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.55 -39.49 93.85 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.211 -0.931 . . . . 0.0 109.667 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -59.82 -34.03 72.53 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.787 ' CG2' HD13 ' A' ' 73' ' ' LEU . 96.5 mt -65.01 -39.92 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.02 -1.05 . . . . 0.0 109.571 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 73' ' ' LEU . 73.8 p -61.82 -46.76 88.09 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.063 -1.023 . . . . 0.0 109.354 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -61.66 -38.96 89.69 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.267 -0.896 . . . . 0.0 108.897 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 1.009 ' CE1' HG22 ' A' ' 53' ' ' ILE . 42.1 t60 -57.22 -48.82 77.83 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.238 -0.914 . . . . 0.0 109.737 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.0 mt -69.49 -39.97 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.648 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.73 -35.98 81.51 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.683 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.31 -37.6 85.78 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.576 HD22 ' HD2' ' A' ' 57' ' ' PHE . 4.3 tp -74.93 -40.52 60.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.114 -0.991 . . . . 0.0 110.032 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.0 t -60.99 -44.0 98.04 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.219 -0.926 . . . . 0.0 109.882 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.4 t . . . . . 0 N--CA 1.494 1.764 0 O-C-N 121.252 -0.905 . . . . 0.0 110.272 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 . . . . . 0 N--CA 1.495 1.787 0 CA-C-O 120.734 0.302 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 -136.73 149.67 47.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.153 -0.967 . . . . 0.0 110.143 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.874 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -120.55 149.82 41.83 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.268 -0.895 . . . . 0.0 110.472 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.0 t -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.251 -0.906 . . . . 0.0 109.666 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.767 HG12 HG23 ' A' ' 32' ' ' ILE . 20.0 m -102.79 106.21 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.143 -0.973 . . . . 0.0 110.671 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -118.26 158.95 24.21 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.917 -1.115 . . . . 0.0 110.476 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CD2' HD11 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -101.69 144.4 30.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.49 -0.756 . . . . 0.0 109.819 179.797 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.95 102.04 0.14 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.245 -0.91 . . . . 0.0 109.879 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -123.42 110.81 15.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 0.0 110.167 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 52.94 88.51 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.06 -1.025 . . . . 0.0 110.708 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.16 131.36 2.76 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 69.1 p -129.86 140.63 50.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -1.175 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -159.01 148.6 18.93 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.168 -0.957 . . . . 0.0 111.477 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.0 126.26 38.08 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 21.1 p -64.25 126.33 27.41 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.261 -1.14 . . . . 0.0 110.837 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 17.3 mttm -75.59 156.71 34.7 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.87 15.07 10.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.974 -1.079 . . . . 0.0 111.492 -178.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.648 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.2 p -175.51 151.44 1.21 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.555 -1.341 . . . . 0.0 110.602 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.63 90.48 8.27 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.989 -1.069 . . . . 0.0 111.731 -177.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.426 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.3 tt0 -168.88 -175.13 2.27 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.257 -0.902 . . . . 0.0 110.64 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.34 153.59 46.87 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.082 -1.011 . . . . 0.0 109.395 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.518 HG21 ' HD3' ' A' ' 31' ' ' ARG . 79.5 mt -106.28 111.29 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.218 -0.926 . . . . 0.0 110.111 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.523 ' O ' HG12 ' A' ' 29' ' ' VAL . 57.5 t -114.19 158.92 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.012 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.4 ' HG3' HG12 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -50.08 133.22 23.28 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.245 -0.909 . . . . 0.0 111.0 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 105.17 6.12 39.72 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 120.163 -1.017 . . . . 0.0 111.754 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.523 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.9 p -127.05 135.86 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 119.77 1.785 . . . . 0.0 110.476 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.427 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 8.2 t -87.72 140.61 29.34 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.115 -0.99 . . . . 0.0 109.975 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.518 ' HD3' HG21 ' A' ' 25' ' ' ILE . 13.0 ptt-85 -135.07 144.31 47.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.198 -0.939 . . . . 0.0 110.324 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.767 HG23 HG12 ' A' ' 8' ' ' VAL . 19.0 mt -108.82 122.56 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 109.351 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.18 162.44 15.24 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.454 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 12.3 pttp -127.86 140.9 51.74 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.277 -1.131 . . . . 0.0 109.405 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 46' ' ' ASP . 60.2 t -109.34 109.18 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.972 -1.08 . . . . 0.0 110.14 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.2 t -121.12 112.62 33.12 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.211 -0.93 . . . . 0.0 109.915 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.96 137.15 26.19 Favored 'Trans proline' 0 N--CA 1.486 1.059 0 O-C-N 123.118 1.062 . . . . 0.0 110.356 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 . . . . . 0 N--CA 1.5 2.036 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.813 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.456 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.407 ' HB3' HG13 ' A' ' 35' ' ' VAL . 0.7 OUTLIER -126.96 149.62 49.76 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.114 -1.227 . . . . 0.0 110.36 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.9 mtt -113.81 135.4 54.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.273 -0.892 . . . . 0.0 110.123 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.435 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 22.3 ttmt -121.75 135.37 54.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.17 -0.956 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -113.09 145.25 41.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.163 -0.96 . . . . 0.0 109.598 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.435 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 11.9 m95 -104.14 112.24 25.16 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.052 -1.03 . . . . 0.0 111.074 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.507 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -124.13 173.68 8.14 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.399 176.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.497 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.8 m80 -93.41 177.66 5.96 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.475 -0.766 . . . . 0.0 110.693 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.569 HG22 ' CE1' ' A' ' 93' ' ' HIS . 30.3 mt -77.24 -54.83 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -57.46 -38.03 73.82 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.032 -1.042 . . . . 0.0 109.695 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 18.8 m -62.3 -50.15 72.79 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.133 -0.979 . . . . 0.0 109.085 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.556 ' SD ' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -70.43 -44.83 67.09 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.388 -0.82 . . . . 0.0 109.522 179.648 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 53' ' ' ILE . 11.4 m-85 -64.47 -29.52 70.56 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.613 179.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -62.21 -42.05 98.94 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.854 -1.154 . . . . 0.0 109.091 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.4 -40.84 73.68 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.734 178.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.556 HD13 ' SD ' ' A' ' 56' ' ' MET . 0.3 OUTLIER -60.42 -41.88 94.88 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.262 -0.899 . . . . 0.0 108.882 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -60.11 -35.09 74.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.474 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.72 31.56 5.18 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.264 -0.897 . . . . 0.0 110.558 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.954 0 O-C-N 120.85 -1.156 . . . . 0.0 110.1 179.871 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt . . . . . 0 N--CA 1.494 1.764 0 CA-C-O 120.766 0.317 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.2 mt 54.86 101.02 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.172 -0.955 . . . . 0.0 110.782 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.23 135.6 44.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.144 -0.973 . . . . 0.0 109.452 179.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 54.64 -162.75 0.13 Allowed 'General case' 0 N--CA 1.502 2.138 0 O-C-N 120.944 -1.098 . . . . 0.0 109.977 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.615 HD13 ' OG1' ' A' ' 91' ' ' THR . 0.7 OUTLIER -132.48 39.08 3.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.022 -1.049 . . . . 0.0 110.602 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.03 35.87 0.84 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.206 -0.934 . . . . 0.0 110.481 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -133.65 37.26 3.3 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.099 -1.001 . . . . 0.0 109.923 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.874 HD22 ' HB3' ' A' ' 6' ' ' PHE . 96.5 mt -136.35 152.73 50.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.228 -0.92 . . . . 0.0 109.75 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -81.16 110.31 16.54 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.069 -1.019 . . . . 0.0 110.097 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.31 -34.75 1.61 Allowed Glycine 0 N--CA 1.494 2.544 0 C-N-CA 119.691 -1.242 . . . . 0.0 111.073 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.409 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 20.2 p-90 -63.95 -31.11 72.18 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.12 1.46 . . . . 0.0 110.759 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.0 tt0 -52.88 -35.17 57.52 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.829 -1.17 . . . . 0.0 110.596 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -82.64 -33.37 27.87 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.031 -1.043 . . . . 0.0 110.291 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.434 HD11 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -51.26 176.68 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.872 0 O-C-N 120.916 -1.115 . . . . 0.0 110.555 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -104.22 160.83 14.55 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.123 -0.986 . . . . 0.0 110.416 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.94 -43.33 95.06 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.197 -0.939 . . . . 0.0 110.313 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -61.62 -50.76 71.28 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.701 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.25 -38.59 89.84 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.481 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.811 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.3 ttpm? -60.52 -38.66 85.11 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.219 -0.926 . . . . 0.0 109.727 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -57.64 -38.19 74.63 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.195 -0.941 . . . . 0.0 110.049 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.26 -38.32 76.68 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.086 -1.009 . . . . 0.0 110.255 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.811 HD12 ' HA ' ' A' ' 87' ' ' LYS . 9.3 mt -64.66 -39.34 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 121.047 -1.033 . . . . 0.0 109.352 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.615 ' OG1' HD13 ' A' ' 73' ' ' LEU . 33.6 m -57.35 -39.54 76.14 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -56.86 -39.11 73.7 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.206 -0.934 . . . . 0.0 109.837 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.569 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.7 m-70 -61.9 -54.27 44.33 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.235 -0.916 . . . . 0.0 109.642 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.448 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.5 mp -62.77 -38.38 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.273 -0.971 . . . . 0.0 109.218 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -38.48 89.02 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.241 -0.912 . . . . 0.0 109.766 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -60.77 -46.67 89.56 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 109.541 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.7 mp -59.25 -35.12 73.12 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.271 -0.893 . . . . 0.0 110.014 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.0 m -102.41 69.64 1.12 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.16 -0.963 . . . . 0.0 110.169 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 16.0 t . . . . . 0 N--CA 1.499 1.983 0 O-C-N 121.094 -1.004 . . . . 0.0 110.04 179.703 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 . . . . . 0 N--CA 1.493 1.687 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -139.38 139.14 37.09 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.17 -0.956 . . . . 0.0 110.337 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.574 ' HE2' ' HH ' ' A' ' 51' ' ' TYR . 2.0 m-85 -115.98 146.63 41.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.254 -0.904 . . . . 0.0 109.999 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.4 m -130.16 159.59 36.36 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.218 -0.926 . . . . 0.0 109.189 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.867 ' CG1' HD23 ' A' ' 76' ' ' LEU . 22.8 m -125.69 105.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.019 -1.051 . . . . 0.0 111.061 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -100.44 141.74 32.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.949 -1.095 . . . . 0.0 109.576 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.465 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 46.8 m-85 -103.99 133.57 48.72 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.22 -0.925 . . . . 0.0 109.721 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.14 133.41 54.99 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -118.25 -58.28 2.0 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -153.68 39.23 0.48 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.168 -0.958 . . . . 0.0 110.642 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -139.25 171.63 23.59 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 m -145.08 127.25 15.69 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.198 -1.177 . . . . 0.0 110.476 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -149.17 143.83 26.2 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.206 -0.934 . . . . 0.0 110.813 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.19 128.0 44.78 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 108.749 -1.74 . . . . 0.0 108.749 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.783 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 32.0 p -64.35 122.55 16.96 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.222 -1.163 . . . . 0.0 110.811 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -68.34 157.25 36.09 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.349 -0.844 . . . . 0.0 108.838 179.69 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 15.79 10.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.842 -1.161 . . . . 0.0 111.83 -179.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.783 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.9 p -175.29 150.09 1.11 Allowed 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.566 -1.334 . . . . 0.0 110.699 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -86.85 89.13 7.86 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.008 -1.058 . . . . 0.0 111.784 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -165.66 -173.34 2.7 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.308 -0.87 . . . . 0.0 110.409 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -130.32 149.75 51.87 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.014 -1.054 . . . . 0.0 109.499 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.566 HG21 HH21 ' A' ' 31' ' ' ARG . 56.5 mt -102.7 134.35 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.263 -0.898 . . . . 0.0 110.006 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.9 m -136.6 169.2 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.267 -0.896 . . . . 0.0 110.322 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.19 127.33 10.44 Favored 'General case' 0 N--CA 1.516 2.857 0 O-C-N 121.583 -0.698 . . . . 0.0 110.948 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.53 8.81 48.58 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.097 -1.049 . . . . 0.0 111.156 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.1 t -111.2 135.65 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.547 1.673 . . . . 0.0 110.014 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.7 t -91.44 123.06 34.58 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.302 -0.874 . . . . 0.0 108.679 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.566 HH21 HG21 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -106.95 133.82 51.03 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.16 -0.963 . . . . 0.0 110.652 -179.351 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.782 HD11 HG12 ' A' ' 53' ' ' ILE . 6.2 mt -106.47 113.1 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.02 135.54 12.2 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 119.723 -1.227 . . . . 0.0 110.361 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.4 ttpm? -111.99 123.93 51.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -1.07 . . . . 0.0 108.986 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.593 HG22 ' HB3' ' A' ' 48' ' ' LYS . 52.2 t -109.29 108.99 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.132 -0.98 . . . . 0.0 110.272 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.402 HG13 ' HG2' ' A' ' 34' ' ' LYS . 33.2 m -123.6 146.94 51.59 Favored Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.215 -0.928 . . . . 0.0 110.24 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.87 146.25 33.0 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.393 1.207 . . . . 0.0 110.173 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.2 t30 . . . . . 0 N--CA 1.499 1.996 0 O-C-N 121.176 -0.953 . . . . 0.0 110.227 179.735 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.479 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -129.36 144.79 51.38 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.23 -1.159 . . . . 0.0 110.112 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 tpt -117.9 146.22 44.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.167 -0.958 . . . . 0.0 110.766 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.593 ' HB3' HG22 ' A' ' 35' ' ' VAL . 16.3 ptpt -131.87 144.78 51.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.24 -0.913 . . . . 0.0 109.671 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -135.56 145.37 46.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.037 -1.04 . . . . 0.0 110.45 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -97.85 115.86 28.91 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.166 -0.959 . . . . 0.0 110.53 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.574 ' HH ' ' HE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.8 171.36 11.29 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.073 -1.017 . . . . 0.0 109.989 177.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.463 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 63.0 m80 -88.44 163.04 16.16 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.782 HG12 HD11 ' A' ' 32' ' ' ILE . 33.4 mt -67.6 -48.12 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -61.14 -40.75 95.0 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.163 -0.961 . . . . 0.0 109.334 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.405 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 35.6 m -64.1 -44.64 91.7 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.268 179.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.491 ' CE ' HD12 ' A' ' 70' ' ' ILE . 5.5 ttp -72.44 -43.26 64.03 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.429 -0.795 . . . . 0.0 109.993 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.477 ' CD2' HG23 ' A' ' 53' ' ' ILE . 16.1 m-85 -71.86 -29.75 64.7 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.794 179.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -78.5 -39.5 38.04 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 120.787 -1.195 . . . . 0.0 109.244 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -73.2 -35.78 66.41 Favored 'General case' 0 N--CA 1.505 2.28 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.367 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 tp -73.37 -40.03 64.69 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.229 -0.919 . . . . 0.0 109.409 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.428 ' OE2' HD12 ' A' ' 97' ' ' LEU . 19.6 mt-10 -69.85 -27.46 64.86 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.061 -1.025 . . . . 0.0 110.349 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.22 -36.3 10.08 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.917 -1.114 . . . . 0.0 110.966 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.858 0 O-C-N 120.956 -1.09 . . . . 0.0 111.075 -179.412 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 30.1 tttp . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 120.66 0.267 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.491 HD12 ' CE ' ' A' ' 56' ' ' MET . 76.0 mt -114.59 99.01 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.237 -0.914 . . . . 0.0 109.814 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -108.84 132.91 53.56 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.293 -0.879 . . . . 0.0 109.801 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 51.24 -165.37 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.094 -1.004 . . . . 0.0 110.493 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.862 HD13 HG21 ' A' ' 90' ' ' ILE . 54.0 tp -122.0 84.22 2.22 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.102 -0.999 . . . . 0.0 110.032 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.469 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.5 OUTLIER -155.72 -54.85 0.09 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.236 -0.915 . . . . 0.0 110.964 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -47.73 -32.71 6.13 Favored 'General case' 0 N--CA 1.518 2.948 0 O-C-N 121.074 -1.016 . . . . 0.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.867 HD23 ' CG1' ' A' ' 8' ' ' VAL . 7.4 mp -72.69 153.18 41.31 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.054 -1.029 . . . . 0.0 110.218 179.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.541 ' O ' HG22 ' A' ' 8' ' ' VAL . 46.8 tt0 -99.65 136.46 39.55 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.266 -0.896 . . . . 0.0 110.697 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.514 ' O ' HD12 ' A' ' 82' ' ' LEU . . . 129.33 -35.07 2.66 Favored Glycine 0 N--CA 1.494 2.563 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 44.3 p-90 -67.29 -15.36 63.65 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 120.923 -1.34 . . . . 0.0 112.123 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -51.19 -37.67 47.94 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.556 -1.34 . . . . 0.0 111.356 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -169.3 54.89 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 120.979 -1.076 . . . . 0.0 112.071 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 78' ' ' GLY . 14.0 mt -111.4 -70.36 0.82 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 109.926 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -122.49 131.17 53.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.072 -1.017 . . . . 0.0 110.133 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -88.16 -50.68 6.22 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.081 -1.012 . . . . 0.0 109.966 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -66.55 -41.74 88.19 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.971 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.381 178.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.865 ' HA ' HD12 ' A' ' 90' ' ' ILE . 35.1 tttt -58.09 -38.93 77.35 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.117 -0.989 . . . . 0.0 109.879 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 2.8 tm-20 -60.93 -40.34 92.85 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.244 -0.91 . . . . 0.0 109.794 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.77 92.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.13 -0.981 . . . . 0.0 110.101 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.865 HD12 ' HA ' ' A' ' 87' ' ' LYS . 11.3 mt -62.19 -40.42 87.55 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 121.191 -0.943 . . . . 0.0 109.746 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 67.3 p -61.51 -39.13 89.87 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.123 -0.986 . . . . 0.0 109.94 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -58.88 -39.87 82.67 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.179 -0.951 . . . . 0.0 109.962 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.552 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.8 m-70 -58.6 -46.15 87.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.171 -0.956 . . . . 0.0 110.163 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.0 mp -61.96 -41.56 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.169 -0.957 . . . . 0.0 108.927 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.34 83.04 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.499 -0.881 . . . . 0.0 109.926 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -71.6 -38.31 70.86 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.136 -0.978 . . . . 0.0 109.81 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.428 HD12 ' OE2' ' A' ' 61' ' ' GLU . 38.0 tp -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.123 -0.985 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 39.5 t -91.89 -40.68 11.03 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.973 -1.079 . . . . 0.0 110.034 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.186 -0.946 . . . . 0.0 110.115 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 . . . . . 0 N--CA 1.494 1.731 0 N-CA-C 110.143 -0.317 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -142.36 145.79 34.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.218 -0.926 . . . . 0.0 110.381 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.778 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -116.69 147.04 42.34 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.193 -0.942 . . . . 0.0 110.202 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.8 t -128.01 148.24 50.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.329 -0.857 . . . . 0.0 108.884 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.841 HG12 HG23 ' A' ' 32' ' ' ILE . 16.9 m -128.82 109.47 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.063 -1.023 . . . . 0.0 110.824 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -123.47 161.46 24.81 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.11 -0.994 . . . . 0.0 110.69 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -102.39 155.64 18.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.495 -0.753 . . . . 0.0 110.072 179.901 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.33 140.01 30.35 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.357 -0.839 . . . . 0.0 110.019 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.3 mttm -114.88 -62.36 1.61 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.149 -0.97 . . . . 0.0 110.269 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -139.35 39.61 2.08 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.255 -0.903 . . . . 0.0 110.335 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.25 124.7 2.59 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.856 HG22 ' HA ' ' A' ' 26' ' ' VAL . 77.3 p -113.75 146.03 40.49 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.198 -1.178 . . . . 0.0 110.163 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -158.15 147.87 19.85 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.227 -0.921 . . . . 0.0 111.175 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.92 121.39 18.49 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 108.761 -1.735 . . . . 0.0 108.761 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.817 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 27.0 p -63.93 123.34 18.73 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.306 -1.114 . . . . 0.0 110.897 -178.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 46.8 mttt -71.59 156.05 39.84 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.577 -0.702 . . . . 0.0 109.256 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 65.51 16.01 10.31 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.875 -1.141 . . . . 0.0 111.638 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.817 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 13.0 p -174.74 150.48 1.32 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.592 -1.318 . . . . 0.0 110.534 178.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.5 92.28 9.12 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.476 -178.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.433 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.65 -174.68 2.55 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 110.667 179.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -131.63 153.3 50.08 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.105 -0.997 . . . . 0.0 109.228 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.898 HG21 ' HD3' ' A' ' 31' ' ' ARG . 80.8 mt -107.91 139.28 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.195 -0.94 . . . . 0.0 110.592 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.856 ' HA ' HG22 ' A' ' 15' ' ' THR . 58.1 t -137.58 161.46 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.435 -0.791 . . . . 0.0 109.477 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -47.35 130.06 13.17 Favored 'General case' 0 N--CA 1.517 2.899 0 O-C-N 121.318 -0.864 . . . . 0.0 111.187 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 106.37 8.47 33.12 Favored Glycine 0 N--CA 1.496 2.667 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.992 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.684 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.8 p -124.38 136.09 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 CA-C-N 119.909 1.855 . . . . 0.0 110.441 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.7 t -83.67 141.84 31.2 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.187 -0.946 . . . . 0.0 109.959 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.898 ' HD3' HG21 ' A' ' 25' ' ' ILE . 27.7 mtm180 -119.47 146.6 45.27 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.148 -0.97 . . . . 0.0 110.743 -179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.841 HG23 HG12 ' A' ' 8' ' ' VAL . 5.4 mt -121.22 111.26 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.74 137.94 13.66 Favored Glycine 0 N--CA 1.494 2.54 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.116 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 6' ' ' PHE . 74.2 tttt -108.0 125.32 51.39 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.333 -1.098 . . . . 0.0 109.174 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.4 HG22 ' HB3' ' A' ' 48' ' ' LYS . 55.9 t -101.15 115.15 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.129 -0.982 . . . . 0.0 110.193 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.6 t -117.22 113.55 39.1 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.245 -0.909 . . . . 0.0 109.812 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.6 148.66 53.88 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 123.201 1.106 . . . . 0.0 110.481 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.9 m120 . . . . . 0 N--CA 1.5 2.053 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 179.822 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.519 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.17 127.2 55.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.213 -1.169 . . . . 0.0 110.033 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 54.8 ttp -117.42 147.58 42.56 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.147 -0.971 . . . . 0.0 110.545 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HB3' HG22 ' A' ' 35' ' ' VAL . 11.8 pttm -131.3 143.77 50.78 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 109.857 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -120.43 136.23 54.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.155 -0.966 . . . . 0.0 110.026 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -91.89 112.95 25.08 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.052 -1.03 . . . . 0.0 110.362 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.516 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -125.91 172.05 10.22 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.889 177.494 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.483 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 66.4 m80 -89.63 172.61 8.83 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 119.792 -0.763 . . . . 0.0 110.681 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.527 HG22 ' CE1' ' A' ' 93' ' ' HIS . 37.4 mt -72.83 -53.51 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.65 -39.35 80.33 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.011 -1.056 . . . . 0.0 109.838 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.8 m -62.73 -46.65 87.09 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.116 -0.99 . . . . 0.0 109.486 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.453 ' O ' HD13 ' A' ' 60' ' ' LEU . 12.4 tpt -74.25 -42.75 59.15 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.285 -0.885 . . . . 0.0 109.933 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.525 ' CD2' HG23 ' A' ' 53' ' ' ILE . 20.6 m-85 -70.16 -25.9 63.67 Favored 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 119.214 -0.994 . . . . 0.0 110.044 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -73.74 -38.73 64.65 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.741 -1.224 . . . . 0.0 109.358 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -63.73 -41.82 97.99 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.123 -0.986 . . . . 0.0 109.411 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 56' ' ' MET . 7.4 mp -59.97 -41.09 91.23 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.357 -0.84 . . . . 0.0 109.826 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -66.32 -35.19 79.75 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.25 -0.906 . . . . 0.0 110.496 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -79.78 -36.77 36.64 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.089 -1.007 . . . . 0.0 110.237 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.822 0 O-C-N 121.09 -1.006 . . . . 0.0 110.117 179.809 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.9 mttt . . . . . 0 N--CA 1.493 1.682 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.3 mt 53.17 92.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.036 -1.04 . . . . 0.0 110.319 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -110.57 136.74 49.23 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.194 -0.941 . . . . 0.0 110.022 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.33 -167.09 0.07 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.03 -1.044 . . . . 0.0 110.464 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 1.105 HD22 HG23 ' A' ' 91' ' ' THR . 14.9 tp -117.02 38.56 3.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.194 -0.941 . . . . 0.0 110.791 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.23 37.11 0.84 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.164 -0.96 . . . . 0.0 110.535 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -131.64 37.32 3.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.206 -0.934 . . . . 0.0 109.894 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.778 HD22 ' HB3' ' A' ' 6' ' ' PHE . 92.0 mt -140.43 152.95 46.1 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.186 -0.947 . . . . 0.0 109.79 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -84.69 98.85 10.45 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.159 -0.963 . . . . 0.0 110.186 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 153.45 -36.19 0.75 Allowed Glycine 0 N--CA 1.495 2.615 0 C-N-CA 119.65 -1.262 . . . . 0.0 110.99 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.404 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 27.4 p-90 -57.94 -29.79 65.44 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 120.928 -1.336 . . . . 0.0 111.029 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -52.41 -36.72 54.9 Favored 'General case' 0 N--CA 1.515 2.794 0 O-C-N 120.861 -1.15 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.59 -33.06 41.96 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.161 -0.962 . . . . 0.0 110.243 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.06 170.3 0.02 OUTLIER 'General case' 0 N--CA 1.518 2.94 0 O-C-N 121.024 -1.048 . . . . 0.0 110.934 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -107.56 161.13 15.12 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.177 -0.952 . . . . 0.0 110.515 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.92 -42.72 90.34 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.214 -0.929 . . . . 0.0 110.258 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -61.79 -51.94 66.24 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.264 -0.898 . . . . 0.0 109.483 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.402 ' OE2' ' CZ ' ' A' ' 10' ' ' TYR . 40.8 mt-10 -63.72 -40.0 95.67 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.006 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.548 ' HA ' HD12 ' A' ' 90' ' ' ILE . 13.3 ttpt -59.43 -38.35 80.46 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.351 -0.843 . . . . 0.0 109.845 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -63.21 -36.61 84.2 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.185 -0.947 . . . . 0.0 110.151 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -68.93 -38.29 79.4 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.07 -1.019 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.548 ' CG2' HD11 ' A' ' 73' ' ' LEU . 9.3 mt -68.74 -38.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.409 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 1.105 HG23 HD22 ' A' ' 73' ' ' LEU . 1.8 p -59.01 -37.71 77.55 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.946 -1.096 . . . . 0.0 109.521 178.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -56.4 -37.8 70.64 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.22 -0.925 . . . . 0.0 109.814 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.527 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.61 -54.35 48.09 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.125 -0.984 . . . . 0.0 109.711 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.453 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 9.4 mt -64.79 -39.34 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 C-N-CA 119.399 -0.92 . . . . 0.0 108.984 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.64 87.14 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.409 -0.916 . . . . 0.0 109.504 178.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.6 -49.23 77.42 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.075 -1.016 . . . . 0.0 109.341 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.65 -36.46 78.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.265 -0.897 . . . . 0.0 109.971 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.7 t -103.46 69.54 1.0 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.142 -0.973 . . . . 0.0 110.086 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.6 p . . . . . 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.0 110.162 179.941 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 . . . . . 0 N--CA 1.494 1.746 0 N-CA-C 110.196 -0.298 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.8 ttt85 -142.24 144.88 33.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.122 -0.986 . . . . 0.0 110.349 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.829 ' HB3' HD22 ' A' ' 76' ' ' LEU . 2.1 m-85 -117.71 140.58 49.48 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.206 -0.934 . . . . 0.0 110.203 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.3 t -130.97 125.51 33.57 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.172 -0.955 . . . . 0.0 109.372 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 1.079 HG12 HG23 ' A' ' 32' ' ' ILE . 11.1 m -103.66 134.23 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.135 -0.978 . . . . 0.0 110.352 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.32 108.11 5.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.195 -0.94 . . . . 0.0 110.318 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.772 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -51.02 157.47 0.84 Allowed 'General case' 0 N--CA 1.514 2.752 0 O-C-N 121.135 -0.978 . . . . 0.0 110.528 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.514 ' HB1' ' H ' ' A' ' 27' ' ' LYS . . . -83.44 139.99 32.63 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.306 -0.872 . . . . 0.0 110.002 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -127.46 -58.47 1.26 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.222 -0.924 . . . . 0.0 110.501 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.22 140.53 26.64 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.17 -0.956 . . . . 0.0 110.328 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.31 149.14 16.73 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -116.07 128.52 55.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.19 -1.183 . . . . 0.0 109.938 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.43 131.38 29.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.125 -0.985 . . . . 0.0 110.948 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.6 124.02 35.07 Favored Glycine 0 N--CA 1.493 2.495 0 N-CA-C 108.284 -1.927 . . . . 0.0 108.284 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 22.3 p -64.93 125.78 25.93 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.181 -1.188 . . . . 0.0 111.005 -178.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 157.38 37.26 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.667 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 16.8 10.71 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.878 -1.139 . . . . 0.0 111.395 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.657 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.6 p -177.75 152.42 0.78 Allowed 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.564 -1.335 . . . . 0.0 110.548 178.178 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -89.57 92.12 8.96 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.992 -1.067 . . . . 0.0 111.541 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.431 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.93 -173.61 2.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.401 -0.812 . . . . 0.0 110.325 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -139.19 148.99 43.89 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.014 -1.054 . . . . 0.0 109.911 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.45 ' CG2' ' HB2' ' A' ' 11' ' ' ALA . 6.9 mt -112.25 131.0 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.174 -0.954 . . . . 0.0 109.7 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.62 ' O ' HG13 ' A' ' 26' ' ' VAL . 8.6 p -155.68 84.25 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.138 -0.976 . . . . 0.0 111.28 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.514 ' H ' ' HB1' ' A' ' 11' ' ' ALA . 0.5 OUTLIER 48.7 101.91 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.367 -0.833 . . . . 0.0 112.406 178.812 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 138.0 -22.03 3.13 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 119.392 -1.385 . . . . 0.0 112.219 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p -125.62 139.41 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 CA-C-N 119.737 1.769 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -80.18 141.6 35.51 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.202 -0.936 . . . . 0.0 109.81 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.438 ' HD3' HD13 ' A' ' 25' ' ' ILE . 2.8 ptt85 -129.5 143.74 50.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.225 -0.922 . . . . 0.0 110.276 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 1.079 HG23 HG12 ' A' ' 8' ' ' VAL . 12.3 mt -111.11 126.48 68.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.186 -0.946 . . . . 0.0 109.181 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.9 154.15 16.72 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.491 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 11.3 pttp -127.8 143.43 51.13 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.129 -1.218 . . . . 0.0 109.589 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.3 t -108.53 109.66 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.012 -1.055 . . . . 0.0 109.949 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.9 t -115.39 113.22 43.29 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.186 -0.947 . . . . 0.0 109.829 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.17 150.09 53.01 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 O-C-N 123.196 1.103 . . . . 0.0 110.427 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 . . . . . 0 N--CA 1.499 2.024 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 179.845 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.447 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -146.25 130.06 17.15 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.191 -1.182 . . . . 0.0 110.173 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.6 mtt -117.96 128.22 54.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.133 -0.979 . . . . 0.0 110.588 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -126.83 123.08 36.52 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.171 -0.956 . . . . 0.0 109.792 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -118.27 142.6 47.32 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.134 -0.978 . . . . 0.0 110.411 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -99.25 114.1 26.74 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.173 -0.954 . . . . 0.0 110.611 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.519 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.3 OUTLIER -124.79 174.15 8.11 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.018 -1.051 . . . . 0.0 109.811 177.495 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.499 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 64.4 m80 -92.92 -173.7 3.37 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.454 -0.779 . . . . 0.0 110.664 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.611 HG22 ' CE1' ' A' ' 93' ' ' HIS . 37.9 mm -82.93 -56.63 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -58.56 -38.74 78.49 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.18 -0.95 . . . . 0.0 109.49 178.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.9 m -60.33 -51.31 70.07 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.272 -0.893 . . . . 0.0 109.104 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.467 ' HG2' HD11 ' A' ' 70' ' ' ILE . 10.5 tpt -68.8 -45.42 71.31 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.446 -0.784 . . . . 0.0 109.374 179.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 93' ' ' HIS . 9.5 m-85 -63.07 -30.24 71.44 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.244 -0.983 . . . . 0.0 109.949 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -65.7 -42.13 91.53 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.847 -1.158 . . . . 0.0 109.034 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -65.58 -41.04 93.33 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.277 -0.889 . . . . 0.0 108.979 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 56' ' ' MET . 7.5 mp -55.34 -41.02 71.94 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.139 -0.976 . . . . 0.0 109.152 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.11 -33.91 65.55 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.287 -0.883 . . . . 0.0 109.562 178.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -104.57 30.82 5.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.147 -0.97 . . . . 0.0 110.396 179.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.885 0 O-C-N 120.969 -1.082 . . . . 0.0 110.109 179.963 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 120.681 0.276 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.908 HG23 HD11 ' A' ' 76' ' ' LEU . 80.0 mt 54.14 99.11 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.178 -0.951 . . . . 0.0 110.797 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.9 132.35 54.28 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.0 109.729 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.94 -164.17 0.07 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.023 -1.048 . . . . 0.0 110.777 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.728 HD23 ' HE2' ' A' ' 87' ' ' LYS . 46.0 tp -114.02 -55.42 2.5 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.97 -36.99 60.82 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.014 -1.054 . . . . 0.0 110.724 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -50.62 -31.07 14.99 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.057 -1.027 . . . . 0.0 111.302 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.908 HD11 HG23 ' A' ' 70' ' ' ILE . 89.0 mt -87.35 152.19 22.48 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.889 -1.132 . . . . 0.0 110.305 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -96.31 137.13 35.84 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.243 -0.911 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.56 -49.44 0.85 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.447 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 55.6 p-90 -50.81 -32.0 18.75 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.116 -1.226 . . . . 0.0 111.151 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 3.8 tm-20 -53.52 -28.04 29.09 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.94 -1.1 . . . . 0.0 111.416 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -110.05 24.22 13.3 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.878 -1.139 . . . . 0.0 112.244 -179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.772 HD13 ' CD2' ' A' ' 10' ' ' TYR . 21.6 mt -111.1 -164.8 0.94 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.723 -1.235 . . . . 0.0 109.678 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -88.02 161.85 17.14 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.926 -1.109 . . . . 0.0 110.312 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.13 -49.26 17.81 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.923 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -61.92 -42.7 99.39 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.305 -0.872 . . . . 0.0 109.366 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 21.3 mt-10 -62.58 -40.62 97.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.728 ' HE2' HD23 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -59.3 -39.81 84.19 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.208 -0.932 . . . . 0.0 109.932 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -58.36 -39.69 80.23 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.247 -0.908 . . . . 0.0 110.062 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -59.47 -35.82 74.82 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.6 HG22 HD13 ' A' ' 73' ' ' LEU . 47.9 mm -70.46 -38.39 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.1 -1.0 . . . . 0.0 109.434 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -38.86 92.82 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.031 -1.043 . . . . 0.0 109.391 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -57.23 -35.8 70.13 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.163 -0.961 . . . . 0.0 110.016 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.611 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.7 m-70 -55.57 -50.01 71.21 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.05 -1.031 . . . . 0.0 109.941 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.74 -38.24 81.81 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.314 -0.954 . . . . 0.0 109.15 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.8 -39.63 83.97 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.575 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.43 -39.92 94.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.19 -0.944 . . . . 0.0 109.414 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -82.52 -34.77 27.79 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.9 m -103.69 60.56 0.75 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.133 -0.979 . . . . 0.0 109.983 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.496 1.866 0 O-C-N 121.053 -1.03 . . . . 0.0 110.25 179.906 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 120.586 0.232 . . . . 0.0 110.456 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 -133.69 138.73 46.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.141 -0.974 . . . . 0.0 110.344 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.603 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -131.55 141.04 49.61 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.291 -0.881 . . . . 0.0 109.675 179.986 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.438 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.8 m -152.69 166.72 31.26 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.33 -0.856 . . . . 0.0 109.956 179.199 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.712 HG22 ' HB2' ' A' ' 77' ' ' GLU . 6.1 m -104.64 141.4 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 120.864 -1.148 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.436 ' CB ' ' CZ3' ' A' ' 50' ' ' TRP . 10.1 t0 -136.91 147.92 46.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.298 -0.877 . . . . 0.0 109.261 179.224 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.64 ' CD2' HD13 ' A' ' 82' ' ' LEU . 59.9 m-85 -102.48 154.29 19.23 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.22 -0.925 . . . . 0.0 110.311 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.08 133.9 34.21 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.26 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -134.15 106.06 6.98 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 52.97 95.07 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.041 -1.037 . . . . 0.0 110.806 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.6 144.38 4.81 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.709 -1.356 . . . . 0.0 109.709 179.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 p -117.77 134.49 54.86 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.219 -1.165 . . . . 0.0 110.125 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.83 134.35 49.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.189 -0.944 . . . . 0.0 110.721 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.82 124.62 31.18 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . 22.4 t -62.41 128.53 36.47 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.355 -1.086 . . . . 0.0 109.337 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 145.94 47.97 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.5 mttt 52.58 48.74 21.89 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.901 -1.124 . . . . 0.0 109.732 -179.231 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.69 151.42 9.2 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.351 -0.843 . . . . 0.0 110.656 -178.328 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -101.93 49.76 0.85 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.138 -0.976 . . . . 0.0 108.57 178.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.6 -174.1 4.23 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.474 -0.766 . . . . 0.0 110.18 -178.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -133.31 159.66 39.61 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.118 -0.989 . . . . 0.0 109.914 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.407 HG21 ' HD2' ' A' ' 31' ' ' ARG . 62.9 mt -104.51 105.02 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.409 -0.807 . . . . 0.0 109.526 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.732 ' O ' HG12 ' A' ' 29' ' ' VAL . 12.8 p -104.65 161.66 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.188 -0.945 . . . . 0.0 110.583 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -46.13 138.57 5.17 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.466 -0.771 . . . . 0.0 111.195 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.02 0.77 51.64 Favored Glycine 0 N--CA 1.493 2.466 0 C-N-CA 120.163 -1.018 . . . . 0.0 111.036 -179.202 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.732 HG12 ' O ' ' A' ' 26' ' ' VAL . 10.4 p -125.62 135.58 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-N 119.549 1.674 . . . . 0.0 109.86 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.651 ' HB3' HD11 ' A' ' 53' ' ' ILE . 21.0 t -89.44 138.84 31.09 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 -179.609 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.407 ' HD2' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -127.45 154.1 45.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.334 -0.854 . . . . 0.0 110.138 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.468 HD12 ' CG ' ' A' ' 56' ' ' MET . 20.8 mt -102.07 136.53 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.18 -0.95 . . . . 0.0 110.185 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.439 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.1 126.0 8.51 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.574 -1.81 . . . . 0.0 108.574 179.183 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 74.8 tttt -105.13 114.62 28.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.177 -1.19 . . . . 0.0 109.742 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -96.04 121.2 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.212 -0.93 . . . . 0.0 110.429 -179.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.7 t -119.86 110.75 36.39 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.215 -0.928 . . . . 0.0 109.417 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.03 147.61 43.49 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.24 1.126 . . . . 0.0 110.638 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.8 m120 . . . . . 0 N--CA 1.499 2.014 0 O-C-N 121.268 -0.895 . . . . 0.0 110.006 179.705 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.586 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -143.56 142.47 31.11 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.175 -1.191 . . . . 0.0 110.299 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.6 mtt -116.39 140.59 49.18 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.21 -0.931 . . . . 0.0 110.148 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -129.75 122.64 29.27 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.133 -0.979 . . . . 0.0 110.54 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -116.65 145.45 43.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.142 -0.974 . . . . 0.0 109.694 179.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.439 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 16.6 m95 -97.37 139.82 32.75 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.108 -0.995 . . . . 0.0 110.084 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -125.43 173.19 9.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 110.064 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 1.7 m80 -90.91 -172.67 3.43 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.526 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.975 HG22 ' CE1' ' A' ' 93' ' ' HIS . 44.5 mm -84.79 -40.29 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 120.962 -1.086 . . . . 0.0 109.161 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -86.45 -31.11 21.55 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.997 -1.064 . . . . 0.0 110.634 178.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 78.9 m -66.56 -51.01 61.17 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.951 -1.093 . . . . 0.0 109.923 179.807 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.468 ' CG ' HD12 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -66.22 -40.21 90.14 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.007 -179.716 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.488 ' CD2' ' CD2' ' A' ' 93' ' ' HIS . 5.8 m-85 -70.44 -32.62 70.28 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 118.938 -1.105 . . . . 0.0 109.553 178.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.96 -36.97 78.25 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.97 -1.081 . . . . 0.0 109.592 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -59.29 -40.18 85.33 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.122 -0.986 . . . . 0.0 109.787 179.469 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -57.72 -42.66 84.28 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.194 -0.942 . . . . 0.0 109.327 179.286 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.95 -34.04 71.31 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.625 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -107.55 31.01 5.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.19 -0.944 . . . . 0.0 110.639 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.891 0 O-C-N 120.995 -1.066 . . . . 0.0 110.136 179.854 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.8 mttt . . . . . 0 N--CA 1.494 1.761 0 CA-C-O 120.708 0.29 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.778 ' HA ' HD21 ' A' ' 76' ' ' LEU . 74.5 mt 54.36 98.74 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.14 -0.975 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -112.82 137.55 50.99 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.086 -1.009 . . . . 0.0 109.996 179.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.42 -164.04 0.09 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.998 -1.063 . . . . 0.0 110.704 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.64 HD22 ' OG1' ' A' ' 91' ' ' THR . 56.6 tp -112.87 160.32 18.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.104 -0.997 . . . . 0.0 110.137 -179.778 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.445 HG23 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER 60.36 46.24 10.23 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.037 -1.039 . . . . 0.0 110.178 -179.829 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.767 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.8 mm-40 -112.91 -62.27 1.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.142 -0.974 . . . . 0.0 109.537 179.348 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.778 HD21 ' HA ' ' A' ' 70' ' ' ILE . 0.9 OUTLIER -138.3 65.62 1.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.266 -0.896 . . . . 0.0 109.491 178.732 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.712 ' HB2' HG22 ' A' ' 8' ' ' VAL . 10.2 pt-20 -143.01 141.87 31.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.858 -1.151 . . . . 0.0 110.956 179.492 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.76 68.54 1.89 Allowed Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.186 -1.566 . . . . 0.0 109.186 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.445 ' CE2' HG23 ' A' ' 74' ' ' THR . 58.6 p-90 -91.81 -32.87 15.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.147 -1.208 . . . . 0.0 111.207 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -52.54 -29.42 25.34 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.838 -1.164 . . . . 0.0 111.17 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -94.86 -38.73 10.6 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.852 -1.155 . . . . 0.0 110.618 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.64 HD13 ' CD2' ' A' ' 10' ' ' TYR . 92.5 mt -70.67 -175.69 1.13 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.949 -1.095 . . . . 0.0 110.015 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -63.91 150.13 45.67 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.225 -0.922 . . . . 0.0 110.16 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -88.45 -39.95 13.85 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.246 -0.909 . . . . 0.0 110.32 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -58.03 -40.82 81.83 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 121.245 -0.909 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.431 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.4 mt-10 -59.78 -39.56 85.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.285 -0.884 . . . . 0.0 109.764 179.624 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.447 ' HG2' HD21 ' A' ' 73' ' ' LEU . 3.8 ttpm? -58.69 -38.52 78.41 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.185 -0.947 . . . . 0.0 110.09 179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -59.06 -45.69 90.15 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.733 179.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -59.17 -34.24 71.87 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.224 -0.922 . . . . 0.0 110.164 179.299 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.5 mm -58.9 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.056 -1.028 . . . . 0.0 109.439 179.419 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.64 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -57.69 -41.38 81.53 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.095 -1.003 . . . . 0.0 109.649 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -62.56 -41.55 98.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.214 179.207 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.975 ' CE1' HG22 ' A' ' 53' ' ' ILE . 72.9 t60 -60.65 -46.47 90.18 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.266 -0.896 . . . . 0.0 109.567 179.541 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.457 HG12 ' CE1' ' A' ' 57' ' ' PHE . 25.7 mt -62.41 -39.5 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.181 -0.95 . . . . 0.0 109.396 179.422 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.403 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -60.47 -39.97 89.57 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.202 -0.936 . . . . 0.0 109.717 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -61.44 -44.22 97.5 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.261 -0.9 . . . . 0.0 109.345 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.469 HD22 ' HD1' ' A' ' 57' ' ' PHE . 5.0 tp -60.23 -35.1 74.68 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.353 -0.842 . . . . 0.0 110.035 179.385 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.0 t -100.59 67.29 1.28 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.053 -1.029 . . . . 0.0 110.077 179.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 8.4 m . . . . . 0 N--CA 1.493 1.705 0 O-C-N 121.115 -0.991 . . . . 0.0 110.184 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 . . . . . 0 N--CA 1.495 1.793 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -125.24 153.79 42.63 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.222 -0.924 . . . . 0.0 110.393 -179.92 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.525 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.6 OUTLIER -146.13 134.85 22.28 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.344 -0.848 . . . . 0.0 109.866 -179.943 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 p -152.73 165.49 35.13 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.052 -1.03 . . . . 0.0 109.871 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.614 HG22 ' HB2' ' A' ' 77' ' ' GLU . 11.1 m -101.81 116.23 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 120.91 -1.119 . . . . 0.0 110.606 179.618 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -105.0 141.78 35.97 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.019 -1.051 . . . . 0.0 109.239 179.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 83' ' ' GLU . 73.2 m-85 -100.35 152.14 20.67 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.156 -0.965 . . . . 0.0 110.192 -179.793 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -100.68 135.54 41.96 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.363 -0.836 . . . . 0.0 110.025 179.664 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 mtpt -114.18 -55.1 2.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.146 -0.971 . . . . 0.0 110.348 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -133.8 156.13 48.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.185 -0.947 . . . . 0.0 110.256 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 162.61 24.13 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.803 HG23 ' O ' ' A' ' 25' ' ' ILE . 89.4 m -138.31 145.42 41.2 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.226 -1.161 . . . . 0.0 110.192 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -140.92 141.85 34.49 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.218 -0.926 . . . . 0.0 110.736 -179.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.41 127.58 44.14 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.33 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.807 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 31.3 p -65.74 121.65 15.48 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.148 -1.207 . . . . 0.0 110.931 -178.425 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 29.7 mmtt -66.89 156.32 36.08 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.335 -0.853 . . . . 0.0 108.972 179.717 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.84 16.35 10.41 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.84 -1.163 . . . . 0.0 111.92 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.807 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 7.4 p -175.24 149.33 1.05 Allowed 'General case' 0 N--CA 1.504 2.256 0 O-C-N 120.571 -1.33 . . . . 0.0 110.726 178.095 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -86.64 88.36 7.65 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.021 -1.049 . . . . 0.0 111.678 -178.021 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.406 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.1 tt0 -165.27 -173.73 2.96 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 179.01 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -130.81 153.8 48.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.019 -1.051 . . . . 0.0 109.833 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.803 ' O ' HG23 ' A' ' 15' ' ' THR . 87.4 mt -107.73 122.5 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.277 -0.889 . . . . 0.0 109.969 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.474 HG22 ' HG2' ' A' ' 27' ' ' LYS . 12.2 p -120.09 160.3 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.243 -0.911 . . . . 0.0 110.323 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HG22 ' A' ' 26' ' ' VAL . 3.7 pttt -47.83 132.04 14.84 Favored 'General case' 0 N--CA 1.515 2.821 0 O-C-N 121.386 -0.821 . . . . 0.0 111.28 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.4 8.59 40.53 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.117 -1.039 . . . . 0.0 111.727 -179.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.472 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.7 p -124.97 137.01 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-N 119.723 1.762 . . . . 0.0 110.612 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.1 t -94.43 133.46 38.01 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.161 -0.962 . . . . 0.0 109.942 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.24 148.61 50.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.266 -0.896 . . . . 0.0 110.151 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.42 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 10.1 mt -104.36 123.89 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.083 -1.01 . . . . 0.0 109.425 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.446 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -106.02 143.93 15.77 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 179.569 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.463 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 27.4 tttt -108.37 117.17 33.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -1.136 . . . . 0.0 108.774 179.679 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -96.4 108.7 21.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.01 -1.056 . . . . 0.0 110.467 -179.421 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 37' ' ' PRO . 9.0 p -123.62 143.43 41.7 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.301 -0.874 . . . . 0.0 110.041 179.354 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 36' ' ' VAL . 49.8 Cg_endo -76.22 143.77 25.69 Favored 'Trans proline' 0 C--N 1.317 -1.084 0 O-C-N 123.101 1.053 . . . . 0.0 110.342 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.9 m120 . . . . . 0 N--CA 1.5 2.033 0 O-C-N 121.189 -0.944 . . . . 0.0 110.088 179.783 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.497 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -132.77 151.42 52.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.205 -1.173 . . . . 0.0 110.038 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.6 ttp -113.6 130.99 56.28 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.226 -0.921 . . . . 0.0 110.53 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -139.15 136.77 35.46 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.948 . . . . 0.0 110.084 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -122.1 153.48 38.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.174 -0.954 . . . . 0.0 109.399 179.856 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 16.1 m95 -107.5 114.1 27.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.109 -0.994 . . . . 0.0 111.033 -179.872 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -123.35 171.32 9.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.193 -0.942 . . . . 0.0 109.224 177.412 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.469 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 58.9 m80 -86.72 -175.19 5.32 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.269 -179.78 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.513 HG22 ' ND1' ' A' ' 93' ' ' HIS . 31.9 mm -85.33 -47.06 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 178.211 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -64.85 -40.01 94.46 Favored 'General case' 0 N--CA 1.504 2.234 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.056 178.126 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 51.1 m -62.09 -45.99 91.04 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.084 179.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.418 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -70.19 -46.65 64.15 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.414 -0.804 . . . . 0.0 109.661 179.86 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -67.13 -28.96 68.58 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.975 179.368 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -76.83 -42.74 39.15 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.777 -1.202 . . . . 0.0 108.899 178.545 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.2 tptp -66.77 -39.76 87.98 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.42 -0.912 . . . . 0.0 108.796 178.415 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.587 HD21 ' CB ' ' A' ' 69' ' ' LYS . 6.0 tp -55.74 -41.22 73.61 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.256 -0.902 . . . . 0.0 109.21 178.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -59.75 -34.86 73.5 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.288 -0.883 . . . . 0.0 109.555 178.542 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 -108.77 32.65 4.72 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.145 -0.972 . . . . 0.0 110.538 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.213 0 O-C-N 120.954 -1.092 . . . . 0.0 110.305 179.946 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.587 ' CB ' HD21 ' A' ' 60' ' ' LEU . 18.1 mtmt . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 120.799 0.333 . . . . 0.0 110.563 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.2 mt -111.37 120.2 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -114.05 152.78 30.5 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.273 -0.892 . . . . 0.0 109.724 179.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 52.86 -165.23 0.07 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.027 -1.046 . . . . 0.0 110.487 -179.753 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 1.044 HD11 HG22 ' A' ' 90' ' ' ILE . 1.6 tp -138.02 -164.78 1.68 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.147 -0.971 . . . . 0.0 110.162 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.58 HG22 ' CE2' ' A' ' 79' ' ' TRP . 4.5 p 46.84 43.3 13.13 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.169 -0.957 . . . . 0.0 111.204 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.777 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.1 tp10 -113.43 -55.84 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.251 -0.905 . . . . 0.0 110.055 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.777 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.3 pt? -146.59 63.42 1.2 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.082 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.614 ' HB2' HG22 ' A' ' 8' ' ' VAL . 5.2 pt-20 -144.46 141.28 29.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.063 -1.023 . . . . 0.0 110.699 178.888 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.08 66.2 3.46 Favored Glycine 0 N--CA 1.496 2.672 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.439 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.58 ' CE2' HG22 ' A' ' 74' ' ' THR . 51.1 p-90 -90.91 -39.22 12.41 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.073 -1.251 . . . . 0.0 110.512 179.865 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.86 -24.13 67.44 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.227 -0.921 . . . . 0.0 111.072 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -95.96 -29.63 14.06 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.714 -1.241 . . . . 0.0 111.497 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.1 mt -94.77 -79.79 0.42 Allowed 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.8 -1.187 . . . . 0.0 110.773 -179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 5.8 mt-10 -125.39 132.62 52.74 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.7 -1.25 . . . . 0.0 110.829 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -89.07 -43.94 10.72 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.13 -0.981 . . . . 0.0 109.554 178.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -62.02 -40.99 97.56 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.365 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -56.08 -38.99 71.43 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.219 -0.925 . . . . 0.0 109.683 179.058 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.852 ' HA ' HD12 ' A' ' 90' ' ' ILE . 1.3 ttpt -55.53 -38.17 68.9 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.08 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.4 -44.17 97.61 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 109.607 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -64.11 -39.07 93.25 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.261 -0.899 . . . . 0.0 109.883 179.633 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 1.044 HG22 HD11 ' A' ' 73' ' ' LEU . 12.6 mt -61.41 -35.1 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.219 -0.925 . . . . 0.0 109.546 179.367 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.451 ' OG1' HD22 ' A' ' 73' ' ' LEU . 3.7 m -60.77 -38.95 86.99 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.812 -1.18 . . . . 0.0 109.576 179.134 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -57.13 -38.53 73.6 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.266 -0.896 . . . . 0.0 109.901 179.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.513 ' ND1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -53.05 -43.47 66.68 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.06 -1.025 . . . . 0.0 110.178 179.753 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.461 HD13 HD13 ' A' ' 73' ' ' LEU . 1.5 mp -65.97 -40.55 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.323 -0.951 . . . . 0.0 108.873 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.49 -36.95 81.93 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.969 179.312 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -70.63 -37.75 73.83 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.2 tp -79.73 -31.94 41.12 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.046 -1.034 . . . . 0.0 110.736 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.3 m -92.04 -39.48 11.62 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.192 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 N--CA 1.494 1.748 0 O-C-N 121.081 -1.012 . . . . 0.0 110.1 179.885 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -141.97 135.18 29.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.178 -0.951 . . . . 0.0 110.228 -179.913 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.777 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.1 m-85 -118.37 137.55 53.04 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.212 -0.93 . . . . 0.0 110.127 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.419 ' O ' HG23 ' A' ' 32' ' ' ILE . 11.7 m -122.78 159.47 27.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.186 -0.946 . . . . 0.0 109.295 179.511 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.521 HG12 HG23 ' A' ' 32' ' ' ILE . 25.8 m -130.08 116.17 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.038 -1.038 . . . . 0.0 110.311 179.577 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.16 151.82 37.66 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.999 -1.063 . . . . 0.0 110.298 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.676 ' HB2' HD22 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -104.97 144.77 31.35 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.309 -0.87 . . . . 0.0 109.602 179.739 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.03 113.35 25.02 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.168 -0.957 . . . . 0.0 110.386 -179.762 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -113.48 -56.06 2.45 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.236 -0.915 . . . . 0.0 109.886 179.733 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.2 ttm-85 -125.52 39.02 4.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.178 -0.951 . . . . 0.0 110.133 179.768 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.12 155.06 25.94 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 t -146.59 146.03 30.3 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.286 -1.126 . . . . 0.0 110.279 179.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -156.08 149.01 24.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.193 -0.942 . . . . 0.0 111.589 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.96 125.88 41.02 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.09 140.9 56.57 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.309 -1.112 . . . . 0.0 110.361 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HB2' ' HB3' ' A' ' 49' ' ' GLU . 0.5 OUTLIER -88.99 153.8 20.72 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.944 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.36 33.01 22.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.84 -1.163 . . . . 0.0 109.664 -178.761 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 132.0 0.09 Allowed 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.772 -1.205 . . . . 0.0 109.372 -179.768 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.36 72.61 4.9 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.07 -1.019 . . . . 0.0 109.91 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -151.33 -175.52 5.21 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.247 -0.908 . . . . 0.0 110.318 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -133.38 156.83 46.95 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.914 -1.116 . . . . 0.0 109.756 -179.27 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.604 HD11 ' O ' ' A' ' 50' ' ' TRP . 56.4 mt -105.03 114.95 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.344 -0.847 . . . . 0.0 109.617 179.929 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.623 ' O ' HG12 ' A' ' 29' ' ' VAL . 58.9 t -110.61 160.93 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.21 -0.931 . . . . 0.0 110.3 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -47.11 144.75 2.48 Favored 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.406 -0.809 . . . . 0.0 111.125 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 90.17 9.67 65.17 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.072 -1.061 . . . . 0.0 111.068 -179.35 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.5 p -125.1 133.95 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 119.485 1.642 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 25.4 p -89.99 139.04 30.99 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.167 -0.958 . . . . 0.0 110.0 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.09 150.67 52.04 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.238 -0.913 . . . . 0.0 110.616 -179.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.521 HG23 HG12 ' A' ' 8' ' ' VAL . 20.5 mt -113.32 134.46 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.288 -0.883 . . . . 0.0 109.537 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.78 127.92 9.16 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.473 ' CB ' ' OH ' ' A' ' 51' ' ' TYR . 17.5 tttp -103.15 118.36 36.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.128 -1.219 . . . . 0.0 109.585 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.462 HG22 ' HB2' ' A' ' 48' ' ' LYS . 47.2 t -94.31 119.2 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.175 -0.953 . . . . 0.0 110.189 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.444 HG22 ' HE3' ' A' ' 34' ' ' LYS . 63.0 t -116.44 111.94 41.67 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.201 -0.937 . . . . 0.0 109.698 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.04 140.96 32.15 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 O-C-N 123.123 1.065 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 . . . . . 0 N--CA 1.498 1.944 0 O-C-N 121.178 -0.951 . . . . 0.0 110.138 179.693 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.409 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -143.13 143.64 31.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.168 -1.195 . . . . 0.0 110.227 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.1 ttp -114.85 124.15 51.0 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.208 -0.932 . . . . 0.0 110.25 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.462 ' HB2' HG22 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -138.08 123.09 19.06 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.198 -0.939 . . . . 0.0 110.178 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 19' ' ' LYS . 23.5 mt-10 -120.63 156.41 31.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.092 -1.005 . . . . 0.0 109.818 179.517 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.604 ' O ' HD11 ' A' ' 25' ' ' ILE . 64.8 m95 -100.53 118.63 37.1 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.086 -1.009 . . . . 0.0 110.562 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.473 ' OH ' ' CB ' ' A' ' 34' ' ' LYS . 0.2 OUTLIER -132.58 163.26 29.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.182 -0.949 . . . . 0.0 110.282 178.301 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -58.5 -172.29 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.421 -0.8 . . . . 0.0 109.749 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.511 HG22 ' ND1' ' A' ' 93' ' ' HIS . 41.3 mm -88.12 -50.8 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.097 -1.002 . . . . 0.0 109.118 179.448 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.6 tttp -56.37 -28.33 58.85 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.347 -0.846 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.9 m -65.07 -39.08 92.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 120.856 -1.152 . . . . 0.0 110.251 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.2 tpt -80.31 -40.64 26.4 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.144 -0.973 . . . . 0.0 109.195 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -70.47 -29.29 65.81 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.369 -0.933 . . . . 0.0 109.901 178.526 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -65.96 -38.1 87.71 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.918 -1.114 . . . . 0.0 109.458 179.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -58.08 -37.79 75.15 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.116 -0.99 . . . . 0.0 109.938 179.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.453 ' N ' HD12 ' A' ' 60' ' ' LEU . 11.0 mp -69.34 -41.56 76.47 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 109.519 179.484 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.756 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.8 mm-40 -68.29 -34.56 76.39 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.267 -0.896 . . . . 0.0 110.234 179.465 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -37.09 33.81 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.065 -1.022 . . . . 0.0 110.284 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.756 0 O-C-N 121.013 -1.054 . . . . 0.0 110.093 179.953 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.8 mtmm . . . . . 0 N--CA 1.494 1.736 0 CA-C-O 120.786 0.327 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.734 HG23 HD11 ' A' ' 76' ' ' LEU . 79.5 mt 52.93 94.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 120.982 -1.074 . . . . 0.0 110.596 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -113.04 133.64 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.193 -0.942 . . . . 0.0 109.837 179.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t70 52.7 -163.91 0.08 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.002 -1.061 . . . . 0.0 110.466 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.713 HD22 ' OG1' ' A' ' 91' ' ' THR . 17.0 tp -110.64 -59.5 1.94 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 81.96 0.1 Allowed 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.131 -0.981 . . . . 0.0 109.343 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -166.27 -53.42 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.329 -0.857 . . . . 0.0 110.647 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.777 HD22 ' HB3' ' A' ' 6' ' ' PHE . 94.9 mt -62.38 150.94 38.28 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.262 -0.899 . . . . 0.0 109.462 179.568 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -78.8 118.23 20.66 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.137 -0.977 . . . . 0.0 110.516 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.65 -41.04 0.95 Allowed Glycine 0 N--CA 1.492 2.406 0 C-N-CA 119.646 -1.264 . . . . 0.0 110.942 179.313 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.416 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 30.1 p-90 -57.62 -28.78 63.98 Favored 'General case' 0 N--CA 1.512 2.669 0 CA-C-N 118.838 1.319 . . . . 0.0 111.157 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.1 tp10 -53.66 -27.63 28.6 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.819 -1.176 . . . . 0.0 111.462 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -109.42 24.33 13.24 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.717 -1.239 . . . . 0.0 112.302 -179.342 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.676 HD22 ' HB2' ' A' ' 10' ' ' TYR . 23.8 mt -111.79 -163.33 0.84 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.701 -1.249 . . . . 0.0 109.5 179.283 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -99.64 162.02 13.26 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.93 -1.106 . . . . 0.0 110.47 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.11 -46.98 26.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.263 -0.898 . . . . 0.0 110.08 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -61.52 -46.16 91.14 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.24 -0.913 . . . . 0.0 109.426 179.753 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.452 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 23.1 mt-10 -62.15 -39.91 94.21 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.274 179.095 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.623 ' HA ' HD12 ' A' ' 90' ' ' ILE . 13.6 mtmt -56.0 -37.97 69.84 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.201 -0.937 . . . . 0.0 109.763 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.41 -38.67 74.68 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.224 -0.923 . . . . 0.0 109.879 179.299 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -59.65 -40.73 88.65 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 109.88 179.634 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' A' ' 87' ' ' LYS . 19.2 mt -65.61 -38.29 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 121.317 -0.864 . . . . 0.0 109.399 179.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.713 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -60.52 -38.51 84.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.989 -1.069 . . . . 0.0 109.497 179.042 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -56.82 -38.14 72.18 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.224 -0.923 . . . . 0.0 109.873 179.213 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.511 ' ND1' HG22 ' A' ' 53' ' ' ILE . 2.7 m-70 -56.32 -51.39 68.39 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.092 -1.005 . . . . 0.0 109.777 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.412 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.9 mp -62.29 -38.77 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.256 -0.903 . . . . 0.0 109.324 179.524 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.58 -40.95 89.17 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.204 -0.935 . . . . 0.0 109.526 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.19 -41.83 99.25 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.059 179.177 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.756 HD11 ' HG2' ' A' ' 61' ' ' GLU . 2.3 tp -76.26 -35.03 59.14 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.338 -0.851 . . . . 0.0 109.695 178.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.4 m -106.44 66.85 0.71 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.053 -1.029 . . . . 0.0 110.041 179.626 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.501 2.091 0 O-C-N 121.06 -1.025 . . . . 0.0 110.052 179.765 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 . . . . . 0 N--CA 1.493 1.7 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -115.97 152.47 33.42 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.195 -0.94 . . . . 0.0 110.301 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.535 ' CD1' HD11 ' A' ' 70' ' ' ILE . 0.6 OUTLIER -144.93 135.59 24.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.375 -0.828 . . . . 0.0 109.781 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.487 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.8 m -153.24 165.56 35.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.059 179.227 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.577 HG13 ' HB2' ' A' ' 77' ' ' GLU . 10.2 m -100.75 120.33 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.052 -1.03 . . . . 0.0 110.224 179.451 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.437 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 0.6 OUTLIER -115.15 99.29 7.32 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.102 -0.999 . . . . 0.0 110.099 179.838 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.684 ' CD2' HD13 ' A' ' 82' ' ' LEU . 40.3 m-85 -52.61 156.16 1.97 Allowed 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.144 -0.973 . . . . 0.0 110.427 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.443 ' HB2' ' CG2' ' A' ' 25' ' ' ILE . . . -93.26 112.66 24.65 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.39 -0.819 . . . . 0.0 110.332 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -148.12 38.99 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.309 -0.87 . . . . 0.0 110.416 179.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 ttp85 -151.52 39.42 0.65 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.15 -0.969 . . . . 0.0 110.595 -179.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.84 -171.43 14.52 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 179.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.567 HG23 HG22 ' A' ' 26' ' ' VAL . 61.2 m -117.59 142.85 46.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.251 179.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.0 140.0 25.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.998 . . . . 0.0 110.91 -179.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.19 140.58 44.81 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 108.614 -1.795 . . . . 0.0 108.614 179.254 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.776 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 21.1 p -80.65 125.32 29.87 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.096 -1.238 . . . . 0.0 111.081 -178.882 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 156.99 38.0 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.839 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.54 16.15 10.37 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.813 -1.18 . . . . 0.0 111.411 -178.68 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.776 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 8.0 p -176.46 152.37 1.06 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.528 -1.357 . . . . 0.0 110.589 177.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 tptm -88.91 91.42 8.82 Favored 'General case' 0 N--CA 1.512 2.663 0 O-C-N 120.969 -1.082 . . . . 0.0 111.598 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.428 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.9 tt0 -168.35 -174.41 2.25 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.247 -0.908 . . . . 0.0 110.577 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.5 mttp -128.49 152.76 47.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.001 -1.062 . . . . 0.0 109.709 179.825 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.584 HD13 ' HD3' ' A' ' 31' ' ' ARG . 61.3 mt -107.75 98.85 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.222 -0.924 . . . . 0.0 109.959 -179.982 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.64 ' O ' HG12 ' A' ' 29' ' ' VAL . 60.1 t -105.08 160.58 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.33 -0.856 . . . . 0.0 110.006 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -48.28 134.23 14.87 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 121.442 -0.786 . . . . 0.0 111.085 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.18 6.67 44.87 Favored Glycine 0 N--CA 1.495 2.58 0 C-N-CA 120.176 -1.011 . . . . 0.0 111.496 -179.734 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.64 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.4 p -125.59 137.49 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-N 119.681 1.741 . . . . 0.0 110.45 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 t -92.19 136.35 33.25 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.181 -0.949 . . . . 0.0 110.074 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.584 ' HD3' HD13 ' A' ' 25' ' ' ILE . 5.9 ptt-85 -135.27 149.14 49.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.487 HG23 ' O ' ' A' ' 7' ' ' CYS . 15.6 mt -110.18 126.68 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.181 -0.949 . . . . 0.0 109.784 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.419 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.75 145.16 15.89 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.677 -1.769 . . . . 0.0 108.677 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 28.2 ttpt -111.95 125.08 53.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.192 -1.181 . . . . 0.0 109.057 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.487 HG22 ' HB3' ' A' ' 48' ' ' LYS . 59.7 t -100.26 109.58 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.072 -1.018 . . . . 0.0 110.506 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.59 134.89 24.72 Favored Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.205 -0.934 . . . . 0.0 109.818 179.637 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.24 127.78 11.54 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.107 1.056 . . . . 0.0 110.207 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.1 t30 . . . . . 0 N--CA 1.498 1.97 0 O-C-N 121.146 -0.971 . . . . 0.0 110.186 179.813 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.535 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -116.5 150.52 37.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.258 -1.143 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.3 mtt -111.99 147.39 36.04 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.234 -0.916 . . . . 0.0 110.203 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.487 ' HB3' HG22 ' A' ' 35' ' ' VAL . 5.0 ptpt -143.3 134.61 26.0 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.206 -0.934 . . . . 0.0 110.271 -179.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -112.15 159.57 18.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.754 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CZ3' ' HB2' ' A' ' 9' ' ' ASP . 9.1 m95 -110.7 113.77 26.63 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.024 -1.047 . . . . 0.0 111.311 -179.729 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.528 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.4 OUTLIER -126.13 170.07 12.17 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.27 177.205 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 68.1 m80 -89.21 161.32 16.5 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.836 -0.746 . . . . 0.0 110.463 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.483 HG22 ' ND1' ' A' ' 93' ' ' HIS . 27.9 mt -65.53 -47.14 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.078 178.405 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.2 tttt -61.42 -40.73 95.49 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.279 -0.968 . . . . 0.0 109.214 178.609 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.3 m -63.92 -43.71 95.1 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.316 -0.865 . . . . 0.0 109.013 178.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.406 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -73.34 -45.58 54.28 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.431 -0.793 . . . . 0.0 109.775 179.938 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.467 ' CE2' HG23 ' A' ' 53' ' ' ILE . 10.6 m-85 -65.48 -28.81 69.47 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.618 179.033 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -64.47 -41.99 96.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.831 -1.168 . . . . 0.0 109.034 178.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.1 tptt -72.56 -41.44 65.76 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.375 -0.93 . . . . 0.0 108.702 178.399 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -39.95 94.11 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.529 -0.868 . . . . 0.0 108.857 178.62 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.05 -32.3 66.06 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.128 -0.982 . . . . 0.0 109.663 178.435 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -102.36 28.82 5.61 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.174 -0.954 . . . . 0.0 110.749 179.219 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.877 0 O-C-N 120.794 -1.191 . . . . 0.0 110.356 179.837 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mttp . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 120.804 0.335 . . . . 0.0 110.605 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 6' ' ' PHE . 78.4 mt 54.35 101.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.258 -0.901 . . . . 0.0 111.093 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -112.22 146.65 37.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.319 -0.863 . . . . 0.0 109.014 178.826 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t0 53.81 -161.7 0.12 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.922 -1.111 . . . . 0.0 110.148 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' A' ' 87' ' ' LYS . 4.8 tp -112.54 -60.0 1.93 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.952 -1.092 . . . . 0.0 110.614 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.553 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -72.72 73.36 1.08 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.162 -0.962 . . . . 0.0 109.925 -179.749 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.479 ' CB ' HD23 ' A' ' 76' ' ' LEU . 2.8 mt-10 -129.15 -58.35 1.14 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.19 -0.944 . . . . 0.0 110.309 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.647 HD23 ' N ' ' A' ' 76' ' ' LEU . 1.3 pt? -147.87 63.83 1.12 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.968 -1.083 . . . . 0.0 110.796 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.577 ' HB2' HG13 ' A' ' 8' ' ' VAL . 8.7 pt-20 -144.42 140.2 28.85 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.01 -1.056 . . . . 0.0 110.266 178.299 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.611 ' O ' HD12 ' A' ' 82' ' ' LEU . . . -72.59 69.01 1.2 Allowed Glycine 0 N--CA 1.498 2.814 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.763 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.553 ' CE2' HG22 ' A' ' 74' ' ' THR . 59.5 p-90 -92.49 -36.25 13.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.118 -1.224 . . . . 0.0 110.805 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -53.17 -28.92 28.86 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.057 -1.027 . . . . 0.0 111.363 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -96.38 -34.88 11.38 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.889 -1.132 . . . . 0.0 111.18 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.684 HD13 ' CD2' ' A' ' 10' ' ' TYR . 61.3 mt -74.7 -173.8 1.94 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.956 -1.09 . . . . 0.0 110.256 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.3 152.67 33.06 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.193 -0.942 . . . . 0.0 110.71 -179.399 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -89.78 -39.2 13.27 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.237 -0.914 . . . . 0.0 110.437 179.661 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.89 -44.25 86.59 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.046 -1.033 . . . . 0.0 109.971 -179.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.454 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.3 mt-10 -60.52 -39.81 89.17 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.444 179.175 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.75 ' HG2' HD21 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -55.78 -38.19 69.57 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.904 179.182 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -41.66 90.15 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.865 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.45 -32.7 72.69 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.267 -0.896 . . . . 0.0 110.656 179.858 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.61 ' HB ' HD11 ' A' ' 73' ' ' LEU . 97.2 mt -65.12 -39.0 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 120.979 -1.076 . . . . 0.0 109.675 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.639 ' OG1' HD22 ' A' ' 73' ' ' LEU . 41.6 m -59.01 -39.09 80.82 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.964 -1.085 . . . . 0.0 109.892 179.649 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -56.32 -37.28 69.72 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.203 -0.936 . . . . 0.0 109.975 179.374 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.483 ' ND1' HG22 ' A' ' 53' ' ' ILE . 2.5 m-70 -57.46 -51.96 67.32 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.01 . . . . 0.0 110.008 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.3 mp -64.24 -38.62 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.31 179.642 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.66 81.43 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.203 -0.935 . . . . 0.0 109.741 179.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -66.57 -39.55 88.52 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.179 -0.951 . . . . 0.0 109.873 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -74.31 -34.73 63.57 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.281 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 74.8 m -96.53 58.09 1.69 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.027 -1.045 . . . . 0.0 110.094 179.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 90.9 p . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.131 -0.981 . . . . 0.0 110.253 179.934 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 . . . . . 0 N--CA 1.493 1.712 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.99 151.51 36.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.25 -0.906 . . . . 0.0 110.215 -179.943 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.731 ' O ' HD12 ' A' ' 76' ' ' LEU . 1.1 m-85 -149.27 136.45 19.93 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.304 -0.873 . . . . 0.0 110.205 -179.65 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' ILE . 26.2 p -151.93 157.66 42.1 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.227 -0.921 . . . . 0.0 109.807 178.735 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.753 HG22 ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -102.3 141.44 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.834 -1.166 . . . . 0.0 110.798 179.869 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -141.97 148.24 38.27 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.269 -0.894 . . . . 0.0 109.607 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.443 ' CD2' HD11 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -96.02 151.61 19.29 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.085 -1.01 . . . . 0.0 109.873 179.917 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HB2' ' HD2' ' A' ' 31' ' ' ARG . . . -92.95 147.14 23.09 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.289 -0.882 . . . . 0.0 110.546 -179.578 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -120.1 -57.83 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.29 -0.881 . . . . 0.0 110.056 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -139.29 132.54 29.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.184 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.15 164.67 14.49 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 179.898 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.9 m -135.0 143.71 46.97 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -1.159 . . . . 0.0 110.258 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.32 143.82 34.26 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.222 -0.924 . . . . 0.0 110.884 -179.85 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.05 127.87 13.46 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.09 130.39 44.45 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.358 -1.084 . . . . 0.0 109.381 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.443 ' HB3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -61.92 147.86 45.45 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 109.212 179.793 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 mttt 52.6 45.41 28.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.905 -1.122 . . . . 0.0 109.591 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 31.6 t -164.89 144.72 7.14 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.386 -0.821 . . . . 0.0 110.769 -178.156 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.75 56.71 1.29 Allowed 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -145.63 -172.05 3.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.374 -0.829 . . . . 0.0 110.238 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -135.31 159.29 42.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.193 -0.942 . . . . 0.0 109.629 -179.6 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.684 HG21 ' HG2' ' A' ' 31' ' ' ARG . 74.3 mt -107.92 119.36 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.41 -0.806 . . . . 0.0 110.057 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.686 ' O ' HG12 ' A' ' 29' ' ' VAL . 32.4 m -118.7 166.2 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.202 -0.936 . . . . 0.0 110.584 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -48.13 143.28 4.57 Favored 'General case' 0 N--CA 1.515 2.784 0 O-C-N 121.512 -0.742 . . . . 0.0 111.023 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 96.3 5.83 59.07 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.15 -1.024 . . . . 0.0 111.239 -179.362 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 26' ' ' VAL . 7.1 p -126.89 133.63 68.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 119.545 1.673 . . . . 0.0 109.977 179.796 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.657 ' HB3' HD11 ' A' ' 53' ' ' ILE . 43.2 t -81.13 139.31 35.69 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.052 -1.03 . . . . 0.0 109.341 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.74 ' HD2' ' HB2' ' A' ' 11' ' ' ALA . 7.8 mtp180 -124.21 142.9 50.85 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.176 -0.952 . . . . 0.0 110.697 -178.731 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.548 HD12 ' HG2' ' A' ' 56' ' ' MET . 22.9 mt -96.74 129.01 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.105 -0.997 . . . . 0.0 109.375 178.722 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.9 122.72 7.7 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 58.4 tttt -106.25 122.07 45.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.217 -1.166 . . . . 0.0 109.703 -179.79 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -101.0 115.54 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.996 . . . . 0.0 110.361 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.2 t -120.73 111.67 34.33 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.214 -0.929 . . . . 0.0 109.762 179.826 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.08 131.01 14.91 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.131 1.069 . . . . 0.0 110.431 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 N--CA 1.501 2.076 0 O-C-N 121.231 -0.918 . . . . 0.0 110.035 179.734 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.419 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -133.47 151.17 51.75 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.216 -1.167 . . . . 0.0 110.466 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttt -110.91 142.8 42.49 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.337 -0.852 . . . . 0.0 110.019 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -119.6 124.84 47.34 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.166 -0.959 . . . . 0.0 110.328 -179.769 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -112.15 146.88 37.26 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.142 -0.974 . . . . 0.0 109.627 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 18.0 m95 -98.88 128.17 44.99 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.181 -0.95 . . . . 0.0 110.281 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.443 ' CE2' ' HB3' ' A' ' 19' ' ' LYS . 86.9 m-85 -111.56 172.8 6.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -90.25 -173.09 3.7 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.534 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.891 HG22 ' CE1' ' A' ' 93' ' ' HIS . 40.5 mm -87.28 -38.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.005 -1.06 . . . . 0.0 109.332 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -88.13 -29.33 20.66 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.73 -1.231 . . . . 0.0 110.915 179.116 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.6 m -65.9 -51.66 56.71 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.835 -1.166 . . . . 0.0 110.487 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . 0.548 ' HG2' HD12 ' A' ' 32' ' ' ILE . 10.6 tpt -66.59 -39.75 88.56 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.178 -179.509 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.458 ' HD1' HD22 ' A' ' 97' ' ' LEU . 6.7 m-85 -72.87 -30.56 64.08 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.792 179.191 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -67.75 -36.71 81.03 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.918 -1.114 . . . . 0.0 109.639 178.784 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -39.87 86.73 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.045 -1.034 . . . . 0.0 109.82 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -59.08 -43.39 91.8 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.248 179.351 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.5 ' HG3' HD11 ' A' ' 97' ' ' LEU . 3.8 mt-10 -57.82 -34.67 69.92 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.194 -0.941 . . . . 0.0 109.484 178.497 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 6.9 ttm105 -103.78 30.77 4.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.399 179.037 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 2.024 0 O-C-N 120.917 -1.115 . . . . 0.0 109.945 179.643 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.737 0 CA-C-O 120.733 0.302 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.9 mt 54.28 99.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.163 -0.961 . . . . 0.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -112.79 134.86 54.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.209 -0.932 . . . . 0.0 109.647 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 t70 53.74 -165.18 0.09 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.964 -1.085 . . . . 0.0 110.451 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.848 HD13 HG22 ' A' ' 91' ' ' THR . 0.3 OUTLIER -114.26 -176.97 3.02 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.103 -0.998 . . . . 0.0 110.218 179.913 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.593 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.5 OUTLIER 46.73 37.3 4.54 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.154 -0.966 . . . . 0.0 111.425 -179.777 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.512 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.9 mm-40 -111.45 -60.05 1.9 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.599 179.547 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.731 HD12 ' O ' ' A' ' 6' ' ' PHE . 1.1 pt? -143.42 62.3 1.38 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.214 -0.929 . . . . 0.0 109.772 178.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.753 ' HB2' HG22 ' A' ' 8' ' ' VAL . 12.8 pt-20 -144.92 141.26 28.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.754 -1.216 . . . . 0.0 111.002 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.02 70.12 1.24 Allowed Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.806 -1.718 . . . . 0.0 108.806 178.859 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.593 ' CE2' HG22 ' A' ' 74' ' ' THR . 60.7 p-90 -90.7 -23.55 20.69 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.313 -1.11 . . . . 0.0 111.787 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -51.77 -32.0 29.15 Favored 'General case' 0 N--CA 1.514 2.756 0 O-C-N 120.702 -1.248 . . . . 0.0 110.768 179.741 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -83.48 -38.6 21.61 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.917 -1.115 . . . . 0.0 109.892 179.243 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.443 HD11 ' CD2' ' A' ' 10' ' ' TYR . 0.2 OUTLIER -51.76 178.63 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.84 0 O-C-N 121.062 -1.024 . . . . 0.0 110.508 -179.925 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -105.68 160.85 14.89 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.127 -0.983 . . . . 0.0 110.415 179.872 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -58.72 -39.79 81.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.272 -0.892 . . . . 0.0 110.403 -179.646 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -66.38 -42.41 87.99 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.249 -0.907 . . . . 0.0 109.705 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.413 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 20.3 mt-10 -66.63 -39.29 88.24 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.513 -0.875 . . . . 0.0 109.416 179.234 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.724 ' HA ' HD12 ' A' ' 90' ' ' ILE . 16.2 ttpp -61.38 -39.08 89.35 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.843 179.334 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 13.6 tt0 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.165 -0.96 . . . . 0.0 110.063 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -63.8 -39.29 93.89 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.151 -0.968 . . . . 0.0 110.083 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.724 HD12 ' HA ' ' A' ' 87' ' ' LYS . 8.3 mt -67.17 -41.15 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.417 0 O-C-N 121.216 -0.928 . . . . 0.0 109.379 179.495 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . 0.848 HG22 HD13 ' A' ' 73' ' ' LEU . 30.5 p -60.83 -38.32 85.08 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.166 -0.959 . . . . 0.0 109.802 179.437 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -57.6 -39.89 77.84 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.113 -0.992 . . . . 0.0 109.845 179.533 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.891 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.8 m-70 -60.2 -52.99 62.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.19 -0.943 . . . . 0.0 109.702 179.651 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.603 ' CD1' HD12 ' A' ' 73' ' ' LEU . 7.9 mt -63.28 -39.21 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 C-N-CA 119.352 -0.939 . . . . 0.0 109.414 179.46 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.02 -41.14 91.37 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.179 -0.95 . . . . 0.0 109.219 178.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -71.07 -42.6 69.19 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.201 -0.937 . . . . 0.0 108.703 178.731 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.5 HD11 ' HG3' ' A' ' 61' ' ' GLU . 2.5 tp -62.53 -34.11 76.25 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.323 -0.861 . . . . 0.0 109.974 178.94 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.4 t -96.92 52.66 1.18 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.115 -0.991 . . . . 0.0 110.165 179.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 N--CA 1.493 1.704 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.911 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.441 ' CB ' HG22 ' A' ' 36' ' ' VAL . 39.8 mt-30 . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 110.199 -0.297 . . . . 0.0 110.199 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.7 156.67 37.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.179 -0.95 . . . . 0.0 110.395 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.511 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -147.34 136.63 22.54 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.423 -0.798 . . . . 0.0 109.915 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.497 ' O ' HG23 ' A' ' 32' ' ' ILE . 26.3 p -152.83 160.93 43.11 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 110.027 178.957 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.67 HG22 ' HB2' ' A' ' 77' ' ' GLU . 6.8 m -101.98 122.57 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 120.926 -1.109 . . . . 0.0 110.612 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.71 154.99 34.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.103 -0.998 . . . . 0.0 110.223 179.58 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.53 149.48 27.09 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.487 -0.758 . . . . 0.0 110.075 -179.798 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.484 ' HB2' HH11 ' A' ' 31' ' ' ARG . . . -111.16 126.29 54.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.244 -0.91 . . . . 0.0 110.127 179.8 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -116.61 -56.18 2.3 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.262 -0.899 . . . . 0.0 110.277 -179.916 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -117.39 93.18 4.07 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.156 -0.965 . . . . 0.0 110.307 -179.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.44 126.74 2.29 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.846 HG22 ' HA ' ' A' ' 26' ' ' VAL . 77.2 p -115.58 145.59 42.53 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.202 -1.175 . . . . 0.0 110.07 179.881 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.92 145.54 28.66 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.195 -0.941 . . . . 0.0 110.879 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.34 130.44 47.7 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.915 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 31.1 p -69.6 117.13 10.82 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.28 -1.129 . . . . 0.0 111.014 -178.722 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 11.8 mmtt -64.59 157.28 27.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.15 -0.969 . . . . 0.0 109.547 179.849 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.52 18.42 11.05 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.519 -1.363 . . . . 0.0 111.395 -178.909 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.915 ' SG ' ' SG ' ' A' ' 18' ' ' CYS . 10.2 p -175.18 143.65 0.69 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.576 -1.328 . . . . 0.0 110.663 178.13 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.87 84.69 7.3 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.017 -1.052 . . . . 0.0 111.914 -177.861 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.403 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 1.3 tt0 -163.6 -174.71 3.83 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 178.687 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.4 ttmm -129.69 156.57 44.04 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.002 -1.061 . . . . 0.0 109.983 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.632 HG23 ' CG1' ' A' ' 29' ' ' VAL . 75.4 mt -109.14 129.53 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.846 ' HA ' HG22 ' A' ' 15' ' ' THR . 33.3 m -125.17 160.39 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.174 -0.954 . . . . 0.0 110.238 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -46.29 134.67 8.62 Favored 'General case' 0 N--CA 1.518 2.931 0 O-C-N 121.43 -0.794 . . . . 0.0 111.452 -179.321 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.43 10.39 44.66 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.386 -179.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.632 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.8 p -125.53 135.9 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 CA-C-N 119.667 1.733 . . . . 0.0 110.424 -179.85 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 45.1 t -92.24 130.28 37.98 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.192 -0.943 . . . . 0.0 109.511 179.26 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.515 ' HD2' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -125.26 150.85 46.67 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.233 -0.917 . . . . 0.0 110.538 -179.693 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.497 HG23 ' O ' ' A' ' 7' ' ' CYS . 22.1 mt -101.65 129.12 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.275 -0.891 . . . . 0.0 109.644 179.747 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.438 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.63 129.67 9.93 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.258 -1.537 . . . . 0.0 109.258 179.967 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 11.4 ttpt -101.85 121.26 41.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.302 -1.116 . . . . 0.0 109.066 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.504 HG22 ' HG3' ' A' ' 48' ' ' LYS . 56.0 t -102.71 110.51 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.022 -1.049 . . . . 0.0 110.552 -179.446 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.441 HG22 ' CB ' ' A' ' 4' ' ' GLN . 57.5 t -121.32 112.09 33.15 Favored Pre-proline 0 N--CA 1.496 1.855 0 O-C-N 121.265 -0.897 . . . . 0.0 109.568 179.612 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.26 126.49 11.11 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.116 1.061 . . . . 0.0 110.451 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.3 m120 . . . . . 0 N--CA 1.499 1.982 0 O-C-N 121.252 -0.905 . . . . 0.0 110.183 179.671 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.543 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.489 ' OD1' HG12 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -114.51 148.4 37.96 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.21 -1.171 . . . . 0.0 110.105 -179.94 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.9 mtt -114.99 119.78 37.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.293 -0.879 . . . . 0.0 110.274 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HG3' HG22 ' A' ' 35' ' ' VAL . 26.3 ttmt -116.1 127.96 55.28 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.208 -0.932 . . . . 0.0 109.988 179.829 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -114.59 124.99 53.24 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.438 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 17.6 m95 -89.01 126.69 35.53 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.187 -0.946 . . . . 0.0 110.057 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.511 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 1.0 OUTLIER -147.21 170.46 17.2 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.527 178.68 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 57.1 m80 -74.72 179.69 4.64 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.658 -0.651 . . . . 0.0 111.217 -178.414 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.522 HG22 ' ND1' ' A' ' 93' ' ' HIS . 33.6 mm -88.57 -48.92 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 179.044 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -60.46 -38.6 84.71 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.342 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.1 m -61.69 -50.01 74.21 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.238 -0.914 . . . . 0.0 109.068 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.4 tpt -68.91 -45.49 70.76 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.729 -0.789 . . . . 0.0 109.385 179.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -63.95 -30.47 71.55 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.615 178.926 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -60.43 -39.79 88.74 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.883 -1.136 . . . . 0.0 109.62 179.143 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.408 179.251 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -59.83 -42.61 93.91 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.126 -0.984 . . . . 0.0 109.173 179.23 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -58.51 -34.49 71.01 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.229 -0.92 . . . . 0.0 109.661 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -105.42 30.19 5.88 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.208 -0.932 . . . . 0.0 110.723 179.261 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 110.104 179.854 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.07 98.25 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.232 -0.917 . . . . 0.0 110.689 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -109.51 134.63 51.66 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.228 -0.92 . . . . 0.0 109.544 179.339 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.405 ' HA ' HG21 ' A' ' 94' ' ' ILE . 0.2 OUTLIER 54.37 -165.36 0.1 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.956 -1.09 . . . . 0.0 110.203 -179.534 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.81 HD11 HG22 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -116.16 -172.41 2.17 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.122 -0.986 . . . . 0.0 110.201 179.872 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.627 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.7 OUTLIER 46.9 37.1 4.51 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.114 -0.992 . . . . 0.0 111.296 -179.577 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.783 ' HB3' HD23 ' A' ' 76' ' ' LEU . 10.4 tt0 -109.81 -58.3 2.07 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.153 -0.967 . . . . 0.0 109.652 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.783 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.2 pt? -145.23 62.2 1.29 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.093 -1.004 . . . . 0.0 109.861 178.668 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.67 ' HB2' HG22 ' A' ' 8' ' ' VAL . 12.4 pt-20 -143.92 140.82 29.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.8 -1.188 . . . . 0.0 110.867 179.321 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.77 70.27 0.95 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.627 ' CE2' HG22 ' A' ' 74' ' ' THR . 61.8 p-90 -90.58 -23.4 20.86 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.23 -1.159 . . . . 0.0 111.644 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -52.47 -34.41 48.94 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.685 -1.259 . . . . 0.0 110.285 179.45 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.68 -39.03 20.71 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.088 -1.007 . . . . 0.0 109.635 178.972 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.12 177.21 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.046 -1.034 . . . . 0.0 110.42 179.787 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -101.31 160.56 14.31 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.137 -0.977 . . . . 0.0 110.413 179.855 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.7 -42.9 98.12 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.26 -0.9 . . . . 0.0 110.101 -179.888 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.69 -41.8 99.3 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.539 -0.865 . . . . 0.0 109.751 179.839 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.402 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 71.4 mt-10 -67.52 -40.56 85.1 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.523 -0.871 . . . . 0.0 109.253 179.109 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -61.3 -38.91 88.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.305 -0.872 . . . . 0.0 109.814 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -58.77 -39.75 81.93 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.258 -0.901 . . . . 0.0 109.922 179.743 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -60.52 -35.73 76.68 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.152 -0.967 . . . . 0.0 110.362 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.81 HG22 HD11 ' A' ' 73' ' ' LEU . 47.7 mm -69.28 -39.2 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.084 -1.01 . . . . 0.0 109.371 179.561 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 73.5 p -61.31 -39.18 89.52 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.023 -1.048 . . . . 0.0 109.603 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -57.61 -36.85 72.32 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.153 -0.967 . . . . 0.0 109.906 179.226 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.522 ' ND1' HG22 ' A' ' 53' ' ' ILE . 12.7 m-70 -59.37 -53.43 58.29 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.127 -0.983 . . . . 0.0 109.878 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.468 ' CD1' HD12 ' A' ' 73' ' ' LEU . 2.4 mp -63.29 -38.55 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.435 179.616 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.24 77.42 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.182 -0.949 . . . . 0.0 109.9 179.198 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.73 -38.4 73.56 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.13 -0.981 . . . . 0.0 109.712 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -78.9 -32.75 45.91 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.116 -0.99 . . . . 0.0 110.315 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.8 t -96.01 54.03 1.43 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.98 -1.075 . . . . 0.0 110.193 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.494 1.767 0 O-C-N 121.126 -0.984 . . . . 0.0 110.227 179.859 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 . . . . . 0 N--CA 1.494 1.746 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.22 145.04 51.05 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.948 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.522 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -150.24 137.6 19.66 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.286 -0.884 . . . . 0.0 109.726 -179.94 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.46 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.7 m -153.3 157.03 39.5 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.157 -0.964 . . . . 0.0 110.258 179.193 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 77' ' ' GLU . 5.7 m -100.98 135.09 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.308 0 O-C-N 121.004 -1.06 . . . . 0.0 110.505 179.637 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.52 157.71 46.21 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.335 -0.853 . . . . 0.0 110.133 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.441 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -107.17 154.91 20.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.407 -0.808 . . . . 0.0 110.085 -179.958 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.97 133.07 37.79 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.319 -0.863 . . . . 0.0 110.061 179.76 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 -55.44 2.44 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.27 -0.894 . . . . 0.0 110.456 -179.805 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 -138.51 105.87 5.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.166 -0.959 . . . . 0.0 110.29 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.75 151.56 6.04 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.421 HG23 HG12 ' A' ' 26' ' ' VAL . 83.8 m -116.11 142.23 47.09 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.226 -1.161 . . . . 0.0 110.033 179.897 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.23 129.74 27.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.141 -0.974 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.77 122.19 25.56 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -61.24 129.91 43.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -1.151 . . . . 0.0 109.441 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.441 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 14.9 tptt -61.98 147.42 47.05 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.168 179.827 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt 52.29 48.45 22.63 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.05 -1.031 . . . . 0.0 109.776 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.5 t -164.43 155.75 15.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.342 -0.849 . . . . 0.0 110.736 -178.147 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.87 44.25 1.04 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.27 -0.894 . . . . 0.0 108.604 178.629 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.35 -174.65 4.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.447 -0.783 . . . . 0.0 110.198 -179.045 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -136.46 156.62 48.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.091 -1.006 . . . . 0.0 109.743 -179.516 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.687 HG23 ' CG1' ' A' ' 29' ' ' VAL . 49.4 mt -97.58 121.56 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.645 179.875 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.421 HG12 HG23 ' A' ' 15' ' ' THR . 34.1 m -129.51 176.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.331 -0.855 . . . . 0.0 110.6 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -43.64 125.88 4.26 Favored 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.784 -0.573 . . . . 0.0 111.334 -179.544 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.16 8.58 50.2 Favored Glycine 0 N--CA 1.492 2.417 0 C-N-CA 120.151 -1.023 . . . . 0.0 110.955 -179.212 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.687 ' CG1' HG23 ' A' ' 25' ' ' ILE . 54.9 t -122.07 134.45 65.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-N 119.562 1.681 . . . . 0.0 109.869 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.701 ' HB3' HD11 ' A' ' 53' ' ' ILE . 51.4 t -96.36 138.03 34.56 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.25 -0.906 . . . . 0.0 108.64 178.516 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.525 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.9 ptt85 -136.05 151.05 49.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.128 -0.982 . . . . 0.0 111.151 -178.924 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.46 HG23 ' O ' ' A' ' 7' ' ' CYS . 20.5 mt -105.01 137.0 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.26 -0.9 . . . . 0.0 109.832 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.411 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.13 127.16 8.7 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 108.934 -1.666 . . . . 0.0 108.934 179.658 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB3' ' CE1' ' A' ' 6' ' ' PHE . 49.6 pttt -110.89 124.05 51.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.154 -1.203 . . . . 0.0 110.08 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -112.72 107.99 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.918 -1.114 . . . . 0.0 110.121 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -122.39 112.23 31.38 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.225 -0.922 . . . . 0.0 109.919 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.74 127.19 12.08 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.198 1.104 . . . . 0.0 110.206 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 . . . . . 0 N--CA 1.499 1.982 0 O-C-N 121.112 -0.992 . . . . 0.0 110.162 179.75 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.467 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.49 133.88 55.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.148 -1.207 . . . . 0.0 110.256 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 37.5 mtt -117.52 138.49 51.86 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.169 -0.957 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 ttmm -117.23 125.77 51.69 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.187 -0.945 . . . . 0.0 109.996 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -114.81 134.6 54.99 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.181 -0.95 . . . . 0.0 109.946 179.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 42.2 m95 -93.09 126.93 38.43 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.31 -0.869 . . . . 0.0 109.655 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.448 ' OH ' ' CE ' ' A' ' 34' ' ' LYS . 98.1 m-85 -112.2 174.66 5.77 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.289 -0.882 . . . . 0.0 110.616 -179.477 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.401 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 1.1 m170 -92.64 -172.35 3.02 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.842 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.93 HG22 ' CE1' ' A' ' 93' ' ' HIS . 35.2 mm -83.74 -41.62 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.928 178.828 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -89.13 -24.29 22.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.01 -1.056 . . . . 0.0 111.384 179.164 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 60.8 m -75.8 -41.44 52.81 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.638 -1.289 . . . . 0.0 110.198 -179.946 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -36.24 67.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.399 -0.92 . . . . 0.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.446 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 11.2 m-85 -80.89 -31.69 35.13 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 119.024 -1.07 . . . . 0.0 109.737 179.089 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -78.79 -33.42 46.28 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.032 -1.042 . . . . 0.0 109.677 178.153 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -72.95 -33.39 65.88 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.028 -1.045 . . . . 0.0 109.979 179.224 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 tp -75.24 -40.15 59.25 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.033 -1.042 . . . . 0.0 109.443 179.291 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -73.5 -30.28 63.03 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.219 -0.925 . . . . 0.0 110.324 178.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.75 -30.47 14.24 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.036 -1.04 . . . . 0.0 111.003 179.918 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 59' ' ' LYS . . . . . . . . 0 N--CA 1.494 1.761 0 O-C-N 120.907 -1.121 . . . . 0.0 110.429 -179.567 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.5 tptm . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 120.679 0.276 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.5 mt -112.51 113.83 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.292 -0.88 . . . . 0.0 109.66 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.414 ' HA ' ' CG2' ' A' ' 94' ' ' ILE . 12.7 mt-10 -110.48 155.04 22.79 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.185 -0.947 . . . . 0.0 110.391 -179.777 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.563 ' N ' HG21 ' A' ' 94' ' ' ILE . 0.8 OUTLIER 50.95 -175.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.06 -1.025 . . . . 0.0 110.897 -179.983 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.673 HD23 ' HG3' ' A' ' 87' ' ' LYS . 15.2 tp -125.61 37.92 4.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.281 -0.887 . . . . 0.0 110.575 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.614 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.6 OUTLIER -145.64 39.19 1.15 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.189 -0.945 . . . . 0.0 110.306 179.661 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.504 ' HB2' HD23 ' A' ' 76' ' ' LEU . 13.9 mt-10 -109.75 -58.61 2.03 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.204 -0.935 . . . . 0.0 109.581 179.452 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.631 HD23 ' N ' ' A' ' 76' ' ' LEU . 1.3 pt? -145.28 62.69 1.29 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.235 -0.916 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.726 ' HB2' HG22 ' A' ' 8' ' ' VAL . 0.7 OUTLIER -145.86 141.0 27.45 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.902 -1.124 . . . . 0.0 111.062 179.394 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.89 69.24 2.45 Favored Glycine 0 N--CA 1.496 2.675 0 N-CA-C 108.943 -1.663 . . . . 0.0 108.943 179.227 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.614 ' CE2' HG22 ' A' ' 74' ' ' THR . 61.7 p-90 -89.08 -23.49 22.51 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.248 -1.148 . . . . 0.0 111.783 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -52.12 -33.55 40.41 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.581 -1.324 . . . . 0.0 110.692 179.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.73 -38.43 28.77 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.953 -1.092 . . . . 0.0 109.817 179.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.403 ' CD2' ' CD1' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -50.88 177.58 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.139 -0.976 . . . . 0.0 110.686 -179.991 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -102.75 160.45 14.58 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.122 -0.986 . . . . 0.0 110.355 179.823 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -60.94 -43.5 98.6 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.259 -0.9 . . . . 0.0 110.177 -179.819 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -61.27 -50.57 72.49 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.27 -0.893 . . . . 0.0 109.56 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 1.2 mp0 -62.92 -41.04 99.34 Favored 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.157 178.975 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.673 ' HG3' HD23 ' A' ' 73' ' ' LEU . 1.3 ttpm? -60.09 -38.46 82.98 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.35 -0.844 . . . . 0.0 110.005 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.84 -39.14 93.09 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.227 -0.92 . . . . 0.0 110.065 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -39.82 87.69 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.103 -0.998 . . . . 0.0 110.006 179.791 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 87' ' ' LYS . 13.6 mt -66.13 -39.73 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.197 -0.939 . . . . 0.0 109.395 179.45 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.49 -37.9 79.46 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.171 -0.956 . . . . 0.0 109.955 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -58.29 -39.86 80.41 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.194 -0.942 . . . . 0.0 109.814 179.454 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.93 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.84 -50.83 72.52 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.178 -0.951 . . . . 0.0 110.076 179.813 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . 0.563 HG21 ' N ' ' A' ' 72' ' ' ASP . 4.1 mt -58.88 -38.4 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.18 -0.95 . . . . 0.0 110.015 179.851 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.65 -38.89 86.32 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.164 -0.96 . . . . 0.0 109.681 179.276 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -59.81 -46.2 89.98 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.168 -0.958 . . . . 0.0 109.596 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.4 mp -57.21 -34.26 68.36 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.116 -0.99 . . . . 0.0 110.381 179.589 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.2 m -97.93 51.41 1.04 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.03 -1.044 . . . . 0.0 110.095 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.1 p . . . . . 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.945 . . . . 0.0 110.1 179.926 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 . . . . . 0 N--CA 1.494 1.73 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -117.51 146.84 43.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.138 -0.976 . . . . 0.0 110.329 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.668 ' CD1' HD11 ' A' ' 70' ' ' ILE . 0.7 OUTLIER -140.28 136.82 33.68 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.317 -0.864 . . . . 0.0 109.88 -179.882 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.512 ' O ' HG23 ' A' ' 32' ' ' ILE . 4.1 m -151.74 160.85 43.44 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.198 -0.939 . . . . 0.0 110.056 178.942 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -101.41 120.9 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.996 -1.065 . . . . 0.0 110.638 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -114.24 146.85 39.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.207 -0.933 . . . . 0.0 109.445 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.575 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.2 OUTLIER -100.22 147.16 26.03 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.854 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.484 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -83.99 128.18 34.37 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.008 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -151.77 38.02 0.59 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.176 -0.952 . . . . 0.0 110.77 179.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.58 50.82 0.18 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.183 -0.948 . . . . 0.0 110.887 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.41 -147.88 16.92 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -133.42 149.17 51.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.27 -1.136 . . . . 0.0 110.333 -179.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.4 132.09 45.6 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.206 -0.934 . . . . 0.0 110.678 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.73 121.9 28.17 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 179.835 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . 0.458 ' HG ' ' HG ' ' A' ' 21' ' ' CYS . 34.8 t -62.78 137.54 58.29 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.324 -1.103 . . . . 0.0 110.298 -179.334 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -88.48 152.84 21.61 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 177.596 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.71 33.18 18.11 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.862 -1.149 . . . . 0.0 109.824 -178.413 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.458 ' HG ' ' HG ' ' A' ' 18' ' ' CYS . 0.0 OUTLIER 179.59 150.78 0.35 Allowed 'General case' 0 N--CA 1.517 2.893 0 O-C-N 120.827 -1.17 . . . . 0.0 109.373 179.77 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -93.96 67.58 3.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.155 -0.965 . . . . 0.0 109.773 179.793 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -149.86 -176.27 5.36 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.256 -0.902 . . . . 0.0 110.403 -179.366 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -132.67 150.9 52.09 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.952 -1.092 . . . . 0.0 109.881 -179.236 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.704 HG23 ' CG2' ' A' ' 29' ' ' VAL . 13.4 mt -104.21 98.29 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.361 -0.837 . . . . 0.0 109.167 179.517 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 49.0 t -85.19 157.61 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 O-C-N 121.305 -0.872 . . . . 0.0 110.514 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -51.3 123.56 9.88 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.261 -0.899 . . . . 0.0 110.725 -179.605 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.19 -18.15 10.38 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 119.937 -1.125 . . . . 0.0 111.363 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.704 ' CG2' HG23 ' A' ' 25' ' ' ILE . 4.4 m -98.9 135.02 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 CA-C-N 119.584 1.692 . . . . 0.0 110.367 -179.51 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.4 p -79.55 131.65 36.08 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.934 179.851 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.518 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.4 ptt-85 -132.81 149.71 52.24 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.278 -0.889 . . . . 0.0 110.091 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.512 HG23 ' O ' ' A' ' 7' ' ' CYS . 17.5 mt -106.25 130.8 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.151 -0.968 . . . . 0.0 109.841 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.435 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.46 138.43 14.25 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.406 -1.878 . . . . 0.0 108.406 179.225 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 9.0 ttpt -107.15 108.96 20.67 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.184 -1.186 . . . . 0.0 109.469 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.447 HG12 ' OD1' ' A' ' 46' ' ' ASP . 52.7 t -85.83 119.64 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.054 -1.029 . . . . 0.0 110.383 -179.755 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.425 HG21 ' HE3' ' A' ' 34' ' ' LYS . 60.9 t -121.41 112.04 33.04 Favored Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.24 -0.912 . . . . 0.0 109.873 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.84 134.33 21.59 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 O-C-N 123.141 1.074 . . . . 0.0 110.544 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 . . . . . 0 N--CA 1.499 1.994 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 179.698 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 2.633 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.447 ' OD1' HG12 ' A' ' 35' ' ' VAL . 1.2 t0 -114.94 133.23 56.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -1.165 . . . . 0.0 109.922 179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.6 mmt -117.3 144.41 44.9 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.182 -0.949 . . . . 0.0 110.523 -179.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -139.84 139.0 36.22 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.357 -0.839 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -111.04 130.91 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.192 -0.942 . . . . 0.0 109.6 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.559 ' O ' HD11 ' A' ' 25' ' ' ILE . 7.8 m95 -89.91 113.54 25.18 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.19 -0.944 . . . . 0.0 109.627 179.768 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.47 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -137.5 168.3 19.93 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.787 -1.165 . . . . 0.0 111.4 178.977 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 60.4 m80 -71.89 158.15 36.56 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.57 -0.706 . . . . 0.0 109.769 -179.151 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.449 ' CG2' ' CD1' ' A' ' 57' ' ' PHE . 51.1 mt -61.67 -44.58 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.264 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -31.4 65.57 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.253 -0.905 . . . . 0.0 110.552 179.461 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.4 m -70.76 -41.08 72.22 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.024 -1.048 . . . . 0.0 109.749 179.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.9 tpt -76.31 -40.58 51.14 Favored 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.964 178.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CD1' ' CG2' ' A' ' 53' ' ' ILE . 7.5 m-85 -64.68 -33.27 75.56 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.543 178.507 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -58.15 -39.6 79.22 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.986 -1.071 . . . . 0.0 109.833 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.5 tttp -63.61 -40.08 95.99 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.585 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.95 -42.67 85.45 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.095 -1.003 . . . . 0.0 109.251 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.0 -35.46 73.28 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.234 -0.916 . . . . 0.0 109.327 178.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -105.78 31.53 4.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.838 0 O-C-N 120.902 -1.124 . . . . 0.0 110.013 179.958 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 120.97 0.414 . . . . 0.0 110.803 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.709 ' HA ' HD21 ' A' ' 76' ' ' LEU . 77.9 mt 52.87 99.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.187 -0.946 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.2 139.6 48.64 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 108.865 178.688 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 55.42 -163.74 0.14 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.948 -1.095 . . . . 0.0 109.712 -179.249 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.552 ' C ' HD23 ' A' ' 73' ' ' LEU . 10.6 tt -106.49 -51.13 3.0 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.925 -1.109 . . . . 0.0 110.685 -179.845 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.402 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -80.73 77.43 7.58 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.097 -1.002 . . . . 0.0 110.167 -179.829 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.757 ' HB3' HD23 ' A' ' 76' ' ' LEU . 29.2 tt0 -138.65 -58.61 0.62 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.131 -0.98 . . . . 0.0 110.499 179.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.757 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.5 pt? -147.62 60.05 1.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.972 -1.08 . . . . 0.0 110.805 179.208 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.6 ' HB2' HG22 ' A' ' 8' ' ' VAL . 10.0 pt-20 -145.2 140.71 28.09 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.81 -1.181 . . . . 0.0 110.71 178.42 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.27 69.33 1.67 Allowed Glycine 0 N--CA 1.497 2.709 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.402 ' CE2' HG22 ' A' ' 74' ' ' THR . 60.1 p-90 -91.47 -38.41 12.57 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.172 -1.193 . . . . 0.0 110.557 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -53.86 -28.3 35.21 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.08 -1.013 . . . . 0.0 111.261 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -91.19 -36.22 14.07 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.872 -1.143 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.575 HD13 ' CD2' ' A' ' 10' ' ' TYR . 94.5 mt -69.08 -173.93 0.56 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.989 -1.07 . . . . 0.0 109.848 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.34 161.45 30.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.178 -0.952 . . . . 0.0 110.575 -179.562 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -77.6 -36.35 51.97 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.24 -0.912 . . . . 0.0 110.278 179.599 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -52.25 -37.53 55.55 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.989 -1.07 . . . . 0.0 110.126 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.425 ' HG3' ' CE2' ' A' ' 10' ' ' TYR . 0.7 OUTLIER -57.98 -40.57 80.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.205 -0.934 . . . . 0.0 109.311 178.812 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -37.53 64.9 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.325 -0.859 . . . . 0.0 109.984 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -69.0 -41.42 77.84 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.257 -0.902 . . . . 0.0 109.27 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -64.95 -36.32 84.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.229 -0.919 . . . . 0.0 110.022 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.94 -41.1 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 67.8 p -60.15 -38.77 84.15 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.112 -0.992 . . . . 0.0 110.105 179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -58.42 -38.51 77.57 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.214 -0.929 . . . . 0.0 110.061 179.694 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 8.0 m-70 -65.18 -53.52 43.54 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.552 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.77 -34.73 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.25 179.004 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.3 -39.38 71.49 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.148 -0.97 . . . . 0.0 109.55 179.111 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.54 -37.85 85.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 109.663 179.244 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.6 tp -78.85 -29.74 44.76 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.154 -0.966 . . . . 0.0 110.718 179.461 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -103.6 39.39 1.61 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.871 -1.143 . . . . 0.0 110.49 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.3 m . . . . . 0 N--CA 1.5 2.029 0 O-C-N 121.146 -0.971 . . . . 0.0 110.608 179.756 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mmt . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.99 93.88 4.2 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.22 -0.925 . . . . 0.0 110.242 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -119.11 112.82 20.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.177 -0.952 . . . . 0.0 110.192 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -127.4 128.51 45.95 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.188 -0.945 . . . . 0.0 110.251 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.79 126.37 52.98 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.184 -0.948 . . . . 0.0 110.145 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.543 ' HB3' HD11 ' A' ' 76' ' ' LEU . 1.7 m-85 -120.77 142.8 49.22 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.27 -0.894 . . . . 0.0 110.186 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.455 ' O ' HG23 ' A' ' 32' ' ' ILE . 84.4 m -133.96 158.92 42.28 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.2 -0.937 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.73 ' CG2' HD23 ' A' ' 76' ' ' LEU . 58.4 t -116.81 125.76 73.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.149 -0.969 . . . . 0.0 110.05 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -142.61 158.46 43.64 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.147 -0.971 . . . . 0.0 110.668 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.446 ' OH ' ' CG ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -106.84 148.51 28.45 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.462 -0.774 . . . . 0.0 110.026 179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.71 135.89 57.79 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.218 -0.927 . . . . 0.0 109.809 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 18.3 tttt -114.32 -56.44 2.39 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.22 -0.925 . . . . 0.0 110.291 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -153.36 130.97 11.48 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.181 -0.949 . . . . 0.0 110.655 -179.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 104.85 158.19 23.43 Favored Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.893 HG22 HG22 ' A' ' 26' ' ' VAL . 77.0 p -118.14 136.98 53.27 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.208 -1.172 . . . . 0.0 110.063 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -129.07 132.17 47.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.126 -0.984 . . . . 0.0 110.483 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.01 111.27 3.96 Favored Glycine 0 N--CA 1.492 2.372 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.9 t -65.15 157.76 27.82 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.26 -1.141 . . . . 0.0 109.182 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.7 mmtm -87.63 155.54 19.9 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.584 -0.697 . . . . 0.0 110.197 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 69.54 28.26 4.64 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.266 -0.896 . . . . 0.0 111.914 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.5 p -172.1 163.82 6.02 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 120.787 -1.195 . . . . 0.0 111.295 178.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -100.74 53.64 0.86 Allowed 'General case' 0 N--CA 1.497 1.881 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 178.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -136.03 -174.63 3.72 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.481 -0.762 . . . . 0.0 110.355 -178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.6 pttt -139.05 156.44 47.18 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.233 -0.917 . . . . 0.0 109.673 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.636 HG21 ' NH1' ' A' ' 31' ' ' ARG . 41.3 mt -95.52 105.32 16.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 O-C-N 121.368 -0.833 . . . . 0.0 109.564 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.893 HG22 HG22 ' A' ' 15' ' ' THR . 57.4 t -108.57 162.75 6.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 O-C-N 121.241 -0.912 . . . . 0.0 109.931 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -41.07 126.22 2.55 Favored 'General case' 0 N--CA 1.52 3.057 0 O-C-N 121.668 -0.645 . . . . 0.0 111.548 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 110.3 -3.84 29.78 Favored Glycine 0 N--CA 1.492 2.392 0 C-N-CA 120.111 -1.042 . . . . 0.0 111.125 -179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 92.1 t -110.48 134.12 53.72 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 CA-C-N 119.564 1.682 . . . . 0.0 109.871 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.8 t -89.88 132.54 35.23 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.246 -0.909 . . . . 0.0 108.861 178.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.636 ' NH1' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -130.86 151.99 50.68 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.145 -0.972 . . . . 0.0 111.308 -178.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.455 HG23 ' O ' ' A' ' 7' ' ' CYS . 38.5 mt -103.71 139.59 24.22 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.419 -0.801 . . . . 0.0 109.078 179.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.17 128.1 9.41 Favored Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 29.7 tttt -110.41 114.96 28.81 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.277 -1.131 . . . . 0.0 109.738 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.528 HG22 ' HB3' ' A' ' 48' ' ' LYS . 61.7 t -98.72 107.76 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.199 -0.938 . . . . 0.0 110.419 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.405 HG23 ' HD2' ' A' ' 37' ' ' PRO . 10.3 p -124.69 143.14 42.64 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.268 -0.895 . . . . 0.0 109.934 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.405 ' HD2' HG23 ' A' ' 36' ' ' VAL . 50.1 Cg_endo -76.11 127.56 10.02 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.261 1.137 . . . . 0.0 110.292 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.3 m120 -104.35 116.69 60.84 Favored Pre-proline 0 N--CA 1.499 2.012 0 O-C-N 121.193 -0.942 . . . . 0.0 110.21 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -75.06 76.81 3.31 Favored 'Trans proline' 0 N--CA 1.484 0.946 0 O-C-N 123.122 1.064 . . . . 0.0 110.242 179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -149.81 -58.34 0.2 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.186 -0.946 . . . . 0.0 110.59 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.3 t -107.94 158.9 16.96 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.169 -0.957 . . . . 0.0 110.262 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -90.33 -37.61 13.92 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.172 -0.955 . . . . 0.0 110.336 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.9 t -72.21 -40.27 67.96 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.005 -1.06 . . . . 0.0 109.877 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -85.51 77.17 2.1 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.76 -79.07 0.14 Allowed Glycine 0 N--CA 1.493 2.454 0 N-CA-C 109.74 -1.344 . . . . 0.0 109.74 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -116.46 137.28 52.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.186 -1.185 . . . . 0.0 110.166 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.3 ttt -116.97 152.28 34.93 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.234 -0.917 . . . . 0.0 110.244 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HB3' HG22 ' A' ' 35' ' ' VAL . 13.2 pttt -125.03 145.16 50.03 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.266 -0.896 . . . . 0.0 110.617 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -129.28 156.62 43.7 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.211 -0.931 . . . . 0.0 109.652 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 52.0 m95 -101.55 142.3 33.13 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.15 -0.968 . . . . 0.0 110.127 179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -121.3 174.14 6.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.314 -0.866 . . . . 0.0 110.718 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 2.8 m80 -93.65 -173.82 3.29 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.981 HG22 ' CE1' ' A' ' 93' ' ' HIS . 45.5 mm -83.27 -33.73 10.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.32 178.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -90.57 -33.89 15.71 Favored 'General case' 0 N--CA 1.503 2.177 0 O-C-N 120.771 -1.206 . . . . 0.0 110.686 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 73.2 m -63.24 -52.31 62.67 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.927 -1.108 . . . . 0.0 110.307 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.35 -39.1 88.96 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.275 -0.891 . . . . 0.0 110.375 -179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.444 ' CE1' HG13 ' A' ' 94' ' ' ILE . 10.4 m-85 -75.17 -30.35 60.7 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.02 -1.072 . . . . 0.0 109.751 179.027 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -68.23 -36.18 79.08 Favored 'General case' 0 N--CA 1.505 2.305 0 O-C-N 120.981 -1.074 . . . . 0.0 109.564 178.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 41.2 tttm -59.97 -40.05 87.74 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.107 -0.996 . . . . 0.0 109.761 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -59.89 -44.91 93.97 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.261 -0.899 . . . . 0.0 109.738 179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -58.56 -35.1 71.84 Favored 'General case' 0 N--CA 1.51 2.549 0 O-C-N 121.212 -0.93 . . . . 0.0 110.436 179.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.1 ttt-85 -89.71 -29.2 18.91 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.18 -0.95 . . . . 0.0 111.01 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.15 167.64 1.66 Allowed 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.826 -1.171 . . . . 0.0 110.186 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.9 mmm-85 -63.87 156.83 26.35 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.189 -0.945 . . . . 0.0 110.324 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.31 -33.46 22.09 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.317 -0.865 . . . . 0.0 110.655 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 30.3 m -49.9 -35.22 22.84 Favored 'General case' 0 N--CA 1.515 2.785 0 O-C-N 120.929 -1.107 . . . . 0.0 111.035 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.89 128.09 53.55 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.062 -1.024 . . . . 0.0 109.859 179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -114.75 143.32 45.26 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.192 -0.942 . . . . 0.0 110.424 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 19.9 mtpt -126.62 149.78 49.29 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.202 -0.936 . . . . 0.0 109.999 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.4 mt 54.36 98.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 O-C-N 121.116 -0.99 . . . . 0.0 110.562 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -110.29 141.77 42.84 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.139 -0.976 . . . . 0.0 110.02 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.34 -165.56 0.08 Allowed 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.056 -1.027 . . . . 0.0 110.516 -179.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.559 HD21 ' HG3' ' A' ' 87' ' ' LYS . 15.9 tp -114.72 37.64 3.37 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.139 -0.975 . . . . 0.0 110.508 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -152.96 36.74 0.49 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.067 -1.021 . . . . 0.0 110.8 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.653 ' O ' HD12 ' A' ' 76' ' ' LEU . 48.1 mm-40 -125.35 38.81 4.1 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.119 -0.988 . . . . 0.0 109.776 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.73 HD23 ' CG2' ' A' ' 8' ' ' VAL . 1.0 OUTLIER -147.82 153.67 39.48 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.213 -0.93 . . . . 0.0 110.109 -179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -89.95 97.67 11.32 Favored 'General case' 0 N--CA 1.504 2.225 0 O-C-N 121.116 -0.99 . . . . 0.0 110.065 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 152.19 -35.25 0.84 Allowed Glycine 0 N--CA 1.495 2.63 0 C-N-CA 119.724 -1.227 . . . . 0.0 110.963 179.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.448 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 27.2 p-90 -52.09 -30.66 27.07 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 119.006 1.403 . . . . 0.0 111.062 -179.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.448 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.6 tm-20 -60.0 -42.98 95.46 Favored 'General case' 0 N--CA 1.51 2.525 0 O-C-N 120.907 -1.121 . . . . 0.0 109.684 179.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -61.31 -39.46 90.58 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.172 -0.955 . . . . 0.0 109.816 179.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.6 mp -49.93 173.72 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.855 0 O-C-N 121.17 -0.956 . . . . 0.0 110.759 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -107.13 161.85 14.39 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.178 -0.951 . . . . 0.0 110.388 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -55.19 -43.9 74.82 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.132 -0.98 . . . . 0.0 110.481 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -62.43 -51.15 68.67 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.262 -0.899 . . . . 0.0 109.43 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.446 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 0.6 OUTLIER -62.19 -38.88 90.8 Favored 'General case' 0 N--CA 1.506 2.367 0 O-C-N 121.297 -0.877 . . . . 0.0 109.331 179.031 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.559 ' HG3' HD21 ' A' ' 73' ' ' LEU . 24.3 tttt -59.43 -39.19 82.73 Favored 'General case' 0 N--CA 1.508 2.431 0 O-C-N 121.233 -0.917 . . . . 0.0 109.775 179.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 21.9 mt-10 -59.99 -40.0 87.64 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.715 179.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -64.12 -38.94 92.86 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.219 -0.926 . . . . 0.0 110.019 179.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.49 ' CD1' HD12 ' A' ' 53' ' ' ILE . 45.9 mm -68.45 -41.51 83.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.152 -0.967 . . . . 0.0 109.026 179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.543 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -60.55 -38.17 83.62 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.23 -0.919 . . . . 0.0 109.935 179.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -58.93 -40.23 83.97 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.149 -0.97 . . . . 0.0 109.991 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.981 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.3 m-70 -59.93 -47.61 85.08 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.206 -0.934 . . . . 0.0 109.933 179.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' CE1' ' A' ' 57' ' ' PHE . 19.4 mt -63.67 -39.25 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.202 -0.936 . . . . 0.0 109.61 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.96 -41.03 95.83 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.216 -0.927 . . . . 0.0 109.438 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -72.24 -40.44 67.71 Favored 'General case' 0 N--CA 1.505 2.284 0 O-C-N 121.229 -0.919 . . . . 0.0 109.088 178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.425 HD22 ' HD1' ' A' ' 57' ' ' PHE . 50.1 tp -68.45 -33.12 73.62 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 121.196 -0.94 . . . . 0.0 110.228 179.14 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.7 t -93.96 -58.81 2.13 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.945 -1.097 . . . . 0.0 110.007 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.1 m 52.42 -164.9 0.07 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.04 -1.037 . . . . 0.0 110.89 179.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 53.65 80.06 0.12 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.069 -1.019 . . . . 0.0 110.704 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -116.98 -57.08 2.2 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.248 -0.907 . . . . 0.0 110.114 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -124.91 -65.46 1.03 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.235 -0.916 . . . . 0.0 110.212 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -141.2 66.72 0.49 Allowed Glycine 0 N--CA 1.494 2.545 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.43 HG23 ' O ' ' A' ' 104' ' ' THR . 8.1 t -155.42 58.43 1.89 Allowed Pre-proline 0 N--CA 1.498 1.965 0 O-C-N 121.167 -1.196 . . . . 0.0 110.719 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.4 108.51 2.53 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 O-C-N 123.288 1.152 . . . . 0.0 110.45 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.7 mtpt -129.84 146.78 51.57 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.202 -0.936 . . . . 0.0 110.212 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -142.81 141.16 31.59 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.195 -0.94 . . . . 0.0 110.223 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 52.4 81.76 0.08 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.051 -1.031 . . . . 0.0 110.838 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -133.12 119.13 19.55 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.201 -0.937 . . . . 0.0 110.246 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.5 146.35 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.223 -0.923 . . . . 0.0 110.191 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.12 142.95 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.256 -0.903 . . . . 0.0 110.261 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -118.35 105.48 11.76 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.204 -0.935 . . . . 0.0 110.286 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.92 136.89 53.19 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.188 -0.945 . . . . 0.0 110.261 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.485 ' C ' HD12 ' A' ' 115' ' ' LEU . 27.5 mmtt -122.84 110.14 15.06 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.209 -0.932 . . . . 0.0 110.243 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.485 HD12 ' C ' ' A' ' 114' ' ' LYS . 6.7 mp -117.74 136.47 53.35 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.18 -0.95 . . . . 0.0 110.217 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 37.6 p -119.63 142.56 48.32 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 110.239 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.217 179.982 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 110.191 -0.299 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -118.95 119.16 33.48 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.194 -0.942 . . . . 0.0 110.208 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -124.22 92.54 3.69 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.197 -0.94 . . . . 0.0 110.171 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -127.57 159.38 34.8 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.23 -0.919 . . . . 0.0 110.228 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -119.82 138.44 53.37 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.264 -0.898 . . . . 0.0 110.205 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.642 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.9 m-85 -118.21 150.06 40.04 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.219 -0.925 . . . . 0.0 110.284 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 67.9 m -134.15 156.39 48.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.262 -0.899 . . . . 0.0 110.032 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 52.6 t -109.82 135.54 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 O-C-N 121.118 -0.989 . . . . 0.0 110.028 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -148.35 153.58 38.79 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.185 -0.947 . . . . 0.0 110.852 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -110.87 148.44 32.42 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.41 -0.807 . . . . 0.0 109.549 179.749 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.29 130.92 41.91 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.514 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -138.05 -65.68 0.51 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.171 -0.956 . . . . 0.0 110.432 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ttt85 -116.98 110.87 18.82 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.214 -0.929 . . . . 0.0 110.318 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 107.18 142.34 10.49 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.6 -1.4 . . . . 0.0 109.6 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.599 HG23 ' O ' ' A' ' 25' ' ' ILE . 5.4 m -116.26 135.88 53.5 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.205 -1.174 . . . . 0.0 110.048 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.28 144.51 31.52 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.182 -0.949 . . . . 0.0 110.51 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 24' ' ' LYS . . . -68.7 156.34 53.35 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -91.83 143.86 26.08 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.211 -1.17 . . . . 0.0 108.726 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.452 ' CB ' ' CE2' ' A' ' 51' ' ' TYR . 4.3 mmtt -52.91 147.32 9.32 Favored 'General case' 0 N--CA 1.515 2.801 0 O-C-N 120.86 -1.15 . . . . 0.0 110.311 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 mmtt 53.28 62.01 2.87 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.137 -0.977 . . . . 0.0 110.242 -179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 51.3 t -172.49 148.7 2.04 Favored 'General case' 0 N--CA 1.504 2.242 0 O-C-N 120.917 -1.114 . . . . 0.0 111.913 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 2.3 mmtt -107.45 45.99 0.97 Allowed 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -132.51 -171.84 2.75 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.591 -0.693 . . . . 0.0 109.956 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.436 ' HA ' ' HA2' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -135.3 153.09 51.99 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.026 -1.047 . . . . 0.0 110.535 -179.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.721 HG23 ' CG2' ' A' ' 29' ' ' VAL . 72.0 mt -107.01 112.88 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 121.371 -0.83 . . . . 0.0 109.6 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.493 HG22 ' HG2' ' A' ' 27' ' ' LYS . 13.4 p -111.11 161.19 9.8 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.195 -0.941 . . . . 0.0 110.609 -179.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.493 ' HG2' HG22 ' A' ' 26' ' ' VAL . 1.6 ptpp? -46.22 120.24 2.7 Favored 'General case' 0 N--CA 1.515 2.822 0 O-C-N 121.437 -0.79 . . . . 0.0 111.282 -179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 125.22 -22.0 6.37 Favored Glycine 0 N--CA 1.493 2.458 0 C-N-CA 119.999 -1.096 . . . . 0.0 111.004 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.721 ' CG2' HG23 ' A' ' 25' ' ' ILE . 8.9 m -100.69 138.21 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 CA-C-N 119.342 1.571 . . . . 0.0 110.52 -179.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 42.4 t -82.66 141.96 32.08 Favored 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.233 -0.917 . . . . 0.0 109.798 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.45 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 3.5 ptt85 -138.19 150.41 46.73 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.325 -0.859 . . . . 0.0 110.174 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 24.1 mt -105.62 144.25 15.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.293 -0.879 . . . . 0.0 109.98 -179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.89 132.13 10.99 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.424 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 27.5 ttpt -116.36 115.33 25.69 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.095 -1.238 . . . . 0.0 110.066 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.446 HG22 ' HG3' ' A' ' 48' ' ' LYS . 59.0 t -102.12 111.13 30.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.102 0 O-C-N 121.158 -0.964 . . . . 0.0 110.436 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.8 p -122.51 143.4 39.63 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.195 -0.94 . . . . 0.0 110.257 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -78.38 150.03 24.99 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 O-C-N 123.123 1.065 . . . . 0.0 110.634 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.8 m-20 -102.9 162.76 19.15 Favored Pre-proline 0 N--CA 1.5 2.044 0 O-C-N 121.306 -0.872 . . . . 0.0 110.108 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.13 105.66 1.88 Allowed 'Trans proline' 0 C--N 1.316 -1.132 0 O-C-N 123.386 1.203 . . . . 0.0 110.218 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 3.5 t80 55.26 100.11 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.136 -0.977 . . . . 0.0 110.574 -179.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.5 m -116.94 134.8 54.29 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.119 -0.988 . . . . 0.0 110.197 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -102.26 -48.58 4.15 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.171 -0.955 . . . . 0.0 110.358 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.8 m -88.83 -41.18 12.64 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.17 -0.956 . . . . 0.0 110.256 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -113.82 -170.02 17.06 Favored Glycine 0 N--CA 1.494 2.544 0 N-CA-C 109.719 -1.352 . . . . 0.0 109.719 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.93 -59.69 0.01 OUTLIER Glycine 0 N--CA 1.497 2.734 0 N-CA-C 109.824 -1.311 . . . . 0.0 109.824 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -114.57 152.71 31.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.192 -1.181 . . . . 0.0 110.037 179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.0 mmt -112.56 124.97 53.73 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.276 -0.89 . . . . 0.0 110.35 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.446 ' HG3' HG22 ' A' ' 35' ' ' VAL . 21.0 ttmt -117.7 122.27 43.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.213 -0.929 . . . . 0.0 110.147 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.1 mp0 -127.44 152.21 47.83 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.194 -0.942 . . . . 0.0 109.85 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 72.1 m95 -98.83 141.93 30.99 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.234 -0.916 . . . . 0.0 110.081 179.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.452 ' CE2' ' CB ' ' A' ' 19' ' ' LYS . 96.0 m-85 -120.73 174.25 6.7 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.304 -0.873 . . . . 0.0 110.465 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -95.24 -173.12 2.84 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.949 HG22 ' CE1' ' A' ' 93' ' ' HIS . 40.9 mm -87.16 -37.44 11.11 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 121.051 -1.031 . . . . 0.0 109.263 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.3 ttpt -88.99 -27.95 20.54 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.887 -1.133 . . . . 0.0 110.821 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 65.7 m -71.58 -49.15 43.14 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 120.966 -1.084 . . . . 0.0 109.911 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.35 -37.34 83.09 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.561 -0.856 . . . . 0.0 110.36 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.448 ' CE1' HG13 ' A' ' 94' ' ' ILE . 5.9 m-85 -74.33 -32.8 62.96 Favored 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 118.952 -1.099 . . . . 0.0 109.588 179.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -63.37 -36.74 84.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.216 -0.994 . . . . 0.0 109.49 178.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 24.9 mtpp -59.9 -40.02 87.35 Favored 'General case' 0 N--CA 1.51 2.543 0 O-C-N 121.135 -0.978 . . . . 0.0 109.779 179.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.4 mp -58.11 -45.28 87.52 Favored 'General case' 0 N--CA 1.511 2.611 0 O-C-N 121.179 -0.95 . . . . 0.0 109.262 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -59.56 -36.07 75.47 Favored 'General case' 0 N--CA 1.507 2.416 0 C-N-CA 119.574 -0.851 . . . . 0.0 109.407 178.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.8 ttt-85 -108.61 32.3 4.96 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.311 -0.868 . . . . 0.0 110.368 179.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.604 ' HB2' ' O ' ' A' ' 59' ' ' LYS . . . -110.98 168.39 9.52 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.909 -1.119 . . . . 0.0 110.22 -179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.5 mtt-85 -74.57 157.02 36.18 Favored 'General case' 0 N--CA 1.508 2.447 0 O-C-N 121.254 -0.904 . . . . 0.0 110.129 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -84.78 -33.73 22.95 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.271 -0.893 . . . . 0.0 110.603 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.6 p -50.41 -35.3 27.83 Favored 'General case' 0 N--CA 1.515 2.79 0 O-C-N 120.94 -1.1 . . . . 0.0 111.024 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 37.3 m -108.33 136.89 47.21 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.137 -0.977 . . . . 0.0 110.014 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 25.8 tptt -117.08 144.3 44.82 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.216 -0.928 . . . . 0.0 110.379 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.1 mttt -129.96 139.42 51.08 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.114 -0.991 . . . . 0.0 110.161 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.568 HG23 HD11 ' A' ' 76' ' ' LEU . 77.2 mt 55.18 101.83 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.202 -0.936 . . . . 0.0 110.791 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -108.91 141.45 40.96 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.197 -0.94 . . . . 0.0 109.961 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 53.17 -173.06 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.987 -1.071 . . . . 0.0 110.677 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.677 HD22 ' OG1' ' A' ' 91' ' ' THR . 14.1 tp -98.39 -35.53 10.26 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.178 -0.951 . . . . 0.0 111.102 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -102.8 50.23 0.82 Allowed 'General case' 0 N--CA 1.499 2.005 0 O-C-N 120.918 -1.114 . . . . 0.0 110.446 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -125.5 38.17 4.22 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.196 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.642 HD22 ' HB3' ' A' ' 6' ' ' PHE . 48.4 mt -145.48 155.2 42.96 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.216 -0.927 . . . . 0.0 110.135 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -84.46 97.69 9.67 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 121.055 -1.028 . . . . 0.0 110.277 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.72 -37.32 0.62 Allowed Glycine 0 N--CA 1.497 2.736 0 C-N-CA 119.689 -1.243 . . . . 0.0 111.036 179.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.451 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 34.8 p-90 -55.22 -33.3 62.96 Favored 'General case' 0 N--CA 1.513 2.717 0 O-C-N 120.872 -1.369 . . . . 0.0 110.728 -179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.451 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 4.2 tt0 -54.18 -39.48 66.65 Favored 'General case' 0 N--CA 1.514 2.742 0 O-C-N 120.91 -1.119 . . . . 0.0 110.243 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -72.25 -36.43 69.07 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.212 -0.93 . . . . 0.0 110.02 179.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.43 HD23 ' CB ' ' A' ' 86' ' ' GLU . 0.1 OUTLIER -53.25 -179.87 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.793 0 O-C-N 121.104 -0.998 . . . . 0.0 110.343 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -106.76 161.07 14.99 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.12 -0.987 . . . . 0.0 110.33 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.41 -39.94 81.12 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.205 -0.934 . . . . 0.0 110.391 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -66.23 -42.3 88.83 Favored 'General case' 0 N--CA 1.508 2.461 0 C-N-CA 119.501 -0.88 . . . . 0.0 109.585 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.43 ' CB ' HD23 ' A' ' 82' ' ' LEU . 75.8 mt-10 -66.73 -39.89 88.16 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.539 -0.864 . . . . 0.0 109.359 179.221 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.691 ' HA ' HD12 ' A' ' 90' ' ' ILE . 35.8 mtpt -60.54 -38.38 84.29 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.265 -0.897 . . . . 0.0 109.9 179.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.02 -40.36 84.74 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.202 -0.936 . . . . 0.0 109.879 179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.44 -40.19 96.49 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 110.002 179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 87' ' ' LYS . 12.0 mt -65.38 -40.79 89.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.214 -0.929 . . . . 0.0 109.235 179.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.677 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.9 OUTLIER -59.22 -38.76 80.74 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.177 -0.952 . . . . 0.0 109.958 179.593 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -58.26 -39.94 80.52 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.283 -0.886 . . . . 0.0 109.897 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.949 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.5 m-70 -58.35 -47.39 83.93 Favored 'General case' 0 N--CA 1.511 2.61 0 O-C-N 121.135 -0.978 . . . . 0.0 109.846 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.448 HG13 ' CE1' ' A' ' 57' ' ' PHE . 26.0 mt -66.12 -38.23 81.52 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.241 -0.912 . . . . 0.0 109.511 179.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.45 -40.43 81.1 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.127 -0.983 . . . . 0.0 109.386 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.46 -41.89 68.84 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.217 -0.927 . . . . 0.0 108.836 178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.425 HD22 ' HD1' ' A' ' 57' ' ' PHE . 28.5 tp -71.0 -33.64 70.6 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.345 -0.847 . . . . 0.0 109.815 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 41.3 m -100.67 46.73 0.94 Allowed 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.968 -1.082 . . . . 0.0 110.075 179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.5 t -120.37 139.16 53.2 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.174 -0.954 . . . . 0.0 110.368 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -144.89 48.98 1.3 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.231 -0.918 . . . . 0.0 110.29 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -141.67 56.97 1.5 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.154 -0.966 . . . . 0.0 110.281 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -145.08 57.65 1.27 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.022 -1.049 . . . . 0.0 110.302 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -140.52 -94.39 0.25 Allowed Glycine 0 N--CA 1.494 2.547 0 N-CA-C 109.676 -1.369 . . . . 0.0 109.676 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.448 ' OG1' ' HD3' ' A' ' 105' ' ' PRO . 0.0 OUTLIER -63.91 -57.83 17.15 Favored Pre-proline 0 N--CA 1.508 2.456 0 O-C-N 121.192 -1.181 . . . . 0.0 110.195 -179.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.448 ' HD3' ' OG1' ' A' ' 104' ' ' THR . 47.5 Cg_endo -73.5 134.31 20.35 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 O-C-N 123.28 1.147 . . . . 0.0 110.43 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.5 ttmm -128.99 170.15 13.81 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.15 -0.969 . . . . 0.0 110.245 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? 53.19 179.91 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.144 0 O-C-N 121.007 -1.058 . . . . 0.0 110.756 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 19.0 mttt -152.38 -174.12 4.78 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.212 -0.93 . . . . 0.0 110.675 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.07 161.87 18.24 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.213 -0.929 . . . . 0.0 110.242 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.0 t -123.51 106.55 17.4 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.167 -0.958 . . . . 0.0 110.041 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.8 m -138.08 142.29 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.2 -0.937 . . . . 0.0 110.266 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -132.07 141.93 49.36 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.12 -0.988 . . . . 0.0 110.172 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.41 105.49 10.56 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.24 -0.912 . . . . 0.0 110.268 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.6 tptt -121.21 147.44 45.61 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.263 -0.898 . . . . 0.0 110.273 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.2 tp -117.99 139.42 51.2 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.116 -0.99 . . . . 0.0 110.241 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 19.2 m -124.71 140.46 52.91 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.223 -0.923 . . . . 0.0 110.241 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.201 -180.0 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 31.6 mtt . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.94 86.77 2.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 110.231 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -131.79 164.14 26.67 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.147 -0.97 . . . . 0.0 110.203 -179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -116.23 135.55 53.8 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.186 -0.946 . . . . 0.0 110.111 179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.06 121.65 32.15 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.197 -0.939 . . . . 0.0 110.308 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.595 ' HD1' HG22 ' A' ' 32' ' ' ILE . 0.6 OUTLIER -112.5 144.49 41.87 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.171 -0.955 . . . . 0.0 109.722 179.687 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.7 p -135.65 164.62 27.43 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.899 . . . . 0.0 110.177 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.708 HG13 HD12 ' A' ' 76' ' ' LEU . 34.1 m -125.26 140.77 47.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 O-C-N 121.173 -0.955 . . . . 0.0 110.955 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -146.78 97.4 2.9 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.146 -0.971 . . . . 0.0 110.163 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.62 ' CD2' HD13 ' A' ' 82' ' ' LEU . 7.3 m-85 -54.06 154.61 4.09 Favored 'General case' 0 N--CA 1.512 2.639 0 O-C-N 121.188 -0.945 . . . . 0.0 110.456 -179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.524 ' HB2' ' HE ' ' A' ' 31' ' ' ARG . . . -108.32 131.21 54.96 Favored 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.279 -0.888 . . . . 0.0 110.696 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 11.6 mttp -117.09 -57.81 2.12 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.242 -0.911 . . . . 0.0 109.912 179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.7 mtm-85 -119.12 159.43 23.97 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.242 -0.912 . . . . 0.0 110.02 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.758 ' O ' HG23 ' A' ' 26' ' ' VAL . . . 81.64 162.42 29.59 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.441 -1.464 . . . . 0.0 109.441 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.53 HG23 ' HB ' ' A' ' 26' ' ' VAL . 17.5 m -133.86 144.21 48.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.144 -1.21 . . . . 0.0 110.322 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -135.77 143.42 45.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.159 -0.963 . . . . 0.0 110.737 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -74.37 123.51 7.78 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 11.0 t -62.35 130.61 46.05 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.272 -1.134 . . . . 0.0 109.412 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -61.89 147.8 45.54 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.173 -0.954 . . . . 0.0 109.209 179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? 52.87 46.88 25.87 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.994 -1.066 . . . . 0.0 109.567 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.2 t -165.59 153.93 11.36 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.343 -0.848 . . . . 0.0 110.944 -178.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -105.38 44.66 1.02 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -138.7 -175.03 4.0 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.464 -0.772 . . . . 0.0 109.978 -178.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB3' HG22 ' A' ' 15' ' ' THR . 0.0 OUTLIER -133.56 157.24 46.18 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.203 -0.935 . . . . 0.0 110.06 -179.382 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.923 HG23 ' CG1' ' A' ' 29' ' ' VAL . 59.7 mt -112.61 123.28 68.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.729 0 O-C-N 121.395 -0.816 . . . . 0.0 109.956 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.758 HG23 ' O ' ' A' ' 14' ' ' GLY . 8.9 p -165.45 112.95 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.112 -0.992 . . . . 0.0 111.364 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 60.47 126.76 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.198 -0.939 . . . . 0.0 111.632 179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.48 9.34 81.77 Favored Glycine 0 N--CA 1.496 2.652 0 O-C-N 121.077 -1.014 . . . . 0.0 111.808 179.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.923 ' CG1' HG23 ' A' ' 25' ' ' ILE . 95.1 t -126.66 135.59 63.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.708 1.754 . . . . 0.0 110.085 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.882 ' HB3' HD11 ' A' ' 53' ' ' ILE . 5.4 t -95.78 134.91 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.179 -0.95 . . . . 0.0 109.24 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.844 ' CG ' HG21 ' A' ' 25' ' ' ILE . 25.3 mtm180 -113.6 129.3 56.59 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.127 -0.983 . . . . 0.0 110.771 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.595 HG22 ' HD1' ' A' ' 6' ' ' PHE . 12.2 mt -103.81 128.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.215 -0.928 . . . . 0.0 108.515 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.9 130.52 10.27 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.1 -1.2 . . . . 0.0 110.1 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.406 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 21.0 tttm -107.03 113.53 27.06 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.334 -1.098 . . . . 0.0 109.393 179.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.491 HG22 ' HB3' ' A' ' 48' ' ' LYS . 48.7 t -96.72 112.76 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.142 -0.973 . . . . 0.0 110.538 -179.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.1 t -120.77 111.03 34.69 Favored Pre-proline 0 N--CA 1.494 1.757 0 O-C-N 121.237 -0.914 . . . . 0.0 109.429 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -73.39 127.35 11.77 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.205 1.108 . . . . 0.0 110.427 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -104.26 116.9 60.57 Favored Pre-proline 0 N--CA 1.499 1.99 0 O-C-N 121.179 -0.95 . . . . 0.0 110.084 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.27 76.95 2.95 Favored 'Trans proline' 0 C--N 1.32 -0.969 0 O-C-N 123.196 1.103 . . . . 0.0 110.282 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -147.33 -58.74 0.27 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.106 -0.996 . . . . 0.0 110.479 -179.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -106.98 158.05 17.33 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.237 -0.915 . . . . 0.0 110.193 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -94.41 -38.84 10.76 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.255 -0.903 . . . . 0.0 110.345 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.2 p -57.37 -39.68 76.52 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.13 -0.981 . . . . 0.0 110.152 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -99.58 107.48 3.38 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.381 -1.488 . . . . 0.0 109.381 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -84.68 -70.92 1.33 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -134.58 138.87 44.94 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.235 -1.156 . . . . 0.0 110.298 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.2 mtp -117.02 149.58 40.04 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.173 -0.954 . . . . 0.0 110.233 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.491 ' HB3' HG22 ' A' ' 35' ' ' VAL . 24.0 pttt -129.46 144.91 51.45 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.32 -0.862 . . . . 0.0 110.534 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -122.76 148.06 45.78 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.147 -0.971 . . . . 0.0 109.581 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -93.99 151.07 19.8 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.104 -0.997 . . . . 0.0 110.133 179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.8 m-85 -135.03 173.22 11.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.279 -0.888 . . . . 0.0 110.414 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.436 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.6 OUTLIER -96.03 -172.34 2.54 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.876 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.928 HG22 ' CE1' ' A' ' 93' ' ' HIS . 43.6 mm -84.38 -39.85 14.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 121.09 -1.006 . . . . 0.0 108.777 178.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.8 pttt -89.02 -25.68 21.85 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 120.922 -1.111 . . . . 0.0 111.081 178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 59.7 m -75.95 -42.2 49.31 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.78 -1.2 . . . . 0.0 109.987 179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.04 -38.18 66.62 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.86 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.456 ' CE1' HG13 ' A' ' 94' ' ' ILE . 6.9 m-85 -73.6 -31.82 63.78 Favored 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 119.029 -1.068 . . . . 0.0 109.553 178.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -63.91 -38.24 90.37 Favored 'General case' 0 N--CA 1.505 2.313 0 O-C-N 121.052 -1.03 . . . . 0.0 109.337 178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -41.17 97.7 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.515 179.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.6 tp -59.99 -46.02 90.84 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.287 -0.883 . . . . 0.0 109.302 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -56.35 -33.73 65.95 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.765 178.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 24.7 mtp-105 -105.85 30.24 5.98 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.174 -0.953 . . . . 0.0 110.627 179.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -107.69 167.83 9.68 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.906 -1.121 . . . . 0.0 109.97 179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.0 mtp85 -63.29 155.18 29.3 Favored 'General case' 0 N--CA 1.508 2.441 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.002 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.38 -34.74 20.11 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.265 -0.897 . . . . 0.0 110.632 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -52.05 -36.91 51.89 Favored 'General case' 0 N--CA 1.513 2.686 0 O-C-N 120.964 -1.085 . . . . 0.0 110.708 -179.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.3 m -113.88 119.98 39.13 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.125 -0.984 . . . . 0.0 110.174 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 2.9 tptm -121.34 145.02 48.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.23 -0.919 . . . . 0.0 110.266 -179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.82 158.22 30.74 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.233 -0.917 . . . . 0.0 110.256 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.3 mt 54.41 98.29 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.126 -0.984 . . . . 0.0 110.661 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -114.2 138.06 50.96 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.183 -0.948 . . . . 0.0 110.069 179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.33 -166.01 0.07 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 121.061 -1.024 . . . . 0.0 110.596 -179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.749 HD22 ' OG1' ' A' ' 91' ' ' THR . 4.5 tp -115.63 39.54 2.97 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.176 -0.953 . . . . 0.0 110.374 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.599 HG22 ' CZ2' ' A' ' 79' ' ' TRP . 2.9 p -149.28 38.04 0.78 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.182 -0.949 . . . . 0.0 110.577 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.679 ' C ' HD22 ' A' ' 76' ' ' LEU . 3.2 mp0 -137.02 37.08 2.57 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.23 -0.919 . . . . 0.0 110.247 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.708 HD12 HG13 ' A' ' 8' ' ' VAL . 4.2 mm? -122.09 152.25 40.04 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.113 -0.992 . . . . 0.0 109.906 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -62.35 106.76 0.8 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.312 -0.868 . . . . 0.0 111.359 -178.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 65.81 59.31 7.73 Favored Glycine 0 N--CA 1.492 2.423 0 O-C-N 121.247 -0.908 . . . . 0.0 111.161 178.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.599 ' CZ2' HG22 ' A' ' 74' ' ' THR . 34.9 p-90 -88.94 -38.19 14.67 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 120.967 -1.314 . . . . 0.0 109.952 178.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.474 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 8.5 tm-20 -69.2 -40.74 77.87 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.164 -0.96 . . . . 0.0 109.082 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.24 -28.02 50.36 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 121.199 -0.938 . . . . 0.0 111.144 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.62 HD13 ' CD2' ' A' ' 10' ' ' TYR . 95.6 mt -69.81 -175.06 0.83 Allowed 'General case' 0 N--CA 1.506 2.337 0 O-C-N 120.624 -1.297 . . . . 0.0 109.762 179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -62.76 155.25 27.18 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.168 -0.957 . . . . 0.0 110.06 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -87.88 -41.07 13.46 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.241 -0.912 . . . . 0.0 110.192 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 50.7 t30 -65.66 -43.99 87.7 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.28 -0.887 . . . . 0.0 109.56 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 47.8 mt-10 -64.63 -39.47 93.76 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.332 179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.49 ' HG3' HD21 ' A' ' 73' ' ' LEU . 12.7 tptt -58.52 -39.16 79.34 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.257 -0.902 . . . . 0.0 109.76 179.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -57.7 -37.93 74.33 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.242 -0.911 . . . . 0.0 109.969 179.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -59.24 -39.22 82.08 Favored 'General case' 0 N--CA 1.51 2.533 0 O-C-N 121.232 -0.917 . . . . 0.0 110.062 179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 70.2 mt -64.53 -41.05 91.16 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.454 0 O-C-N 121.169 -0.957 . . . . 0.0 109.058 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.749 ' OG1' HD22 ' A' ' 73' ' ' LEU . 2.0 m -57.08 -38.45 73.34 Favored 'General case' 0 N--CA 1.51 2.553 0 O-C-N 121.179 -0.95 . . . . 0.0 109.966 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -58.11 -40.35 80.99 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.223 -0.923 . . . . 0.0 109.8 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.928 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.1 m-70 -60.39 -50.59 72.98 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.163 -0.961 . . . . 0.0 109.762 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.456 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.0 mt -62.5 -39.44 84.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.188 -0.945 . . . . 0.0 109.471 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.67 -41.31 96.18 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.218 -0.926 . . . . 0.0 109.272 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -71.53 -40.99 69.71 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.028 178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 16.9 tp -69.64 -33.85 73.2 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.282 -0.886 . . . . 0.0 110.073 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 18.2 t -96.44 -65.5 0.96 Allowed 'General case' 0 N--CA 1.502 2.153 0 O-C-N 120.937 -1.102 . . . . 0.0 110.131 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.1 t 52.39 94.7 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.079 -1.013 . . . . 0.0 110.792 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.27 85.63 2.07 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.226 -0.921 . . . . 0.0 110.27 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -138.95 169.71 17.3 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.158 -0.964 . . . . 0.0 110.161 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.42 87.16 2.11 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.213 -0.93 . . . . 0.0 110.173 179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -131.07 -91.79 0.57 Allowed Glycine 0 N--CA 1.493 2.471 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.1 m -119.19 83.14 24.11 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.178 -1.189 . . . . 0.0 110.223 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.7 -172.48 0.95 Allowed 'Trans proline' 0 C--N 1.317 -1.125 0 O-C-N 123.417 1.219 . . . . 0.0 110.409 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 1.6 mtmp? -117.57 141.97 47.74 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.175 -0.953 . . . . 0.0 110.247 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.7 mmmt -124.42 79.86 1.79 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.186 -0.946 . . . . 0.0 110.166 179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 31.5 mttt -139.48 98.06 3.41 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.196 -0.94 . . . . 0.0 110.216 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.32 111.67 17.64 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.148 -0.97 . . . . 0.0 110.268 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . 0.457 HG13 ' O ' ' A' ' 110' ' ' VAL . 10.5 p -131.86 124.04 52.69 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 O-C-N 121.179 -0.951 . . . . 0.0 110.527 179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.0 t -138.31 132.28 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.841 0 O-C-N 121.133 -0.979 . . . . 0.0 110.014 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -118.47 125.69 50.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.189 -0.944 . . . . 0.0 110.23 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.07 111.79 19.37 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.228 -0.92 . . . . 0.0 110.265 179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -117.42 98.05 6.21 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.142 -0.974 . . . . 0.0 110.18 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.4 tp -120.07 135.85 54.79 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.229 -0.92 . . . . 0.0 110.297 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.401 ' O ' ' OG1' ' A' ' 117' ' ' THR . 11.2 m -127.1 117.67 22.86 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.17 -0.956 . . . . 0.0 110.229 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 116' ' ' THR . 78.9 p . . . . . 0 N--CA 1.504 2.266 0 CA-C-O 118.106 -0.95 . . . . 0.0 111.48 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.9 mtm . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.686 0.279 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.78 80.49 1.85 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.193 -0.942 . . . . 0.0 110.118 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -138.12 68.71 1.39 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.209 -0.932 . . . . 0.0 110.221 -179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.634 ' HA ' HG12 ' A' ' 36' ' ' VAL . 2.7 tt0 57.68 107.92 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.128 0 O-C-N 121.081 -1.012 . . . . 0.0 110.814 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 ttt85 -128.13 137.48 52.13 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.134 -0.978 . . . . 0.0 110.271 179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.697 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.5 m-85 -115.98 137.65 51.92 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.136 -0.978 . . . . 0.0 110.162 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -122.25 164.93 17.0 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.25 -0.906 . . . . 0.0 109.308 179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.544 HG12 HG23 ' A' ' 32' ' ' ILE . 32.7 m -134.97 134.3 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 O-C-N 120.926 -1.109 . . . . 0.0 110.815 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -139.93 147.63 40.81 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.211 -0.93 . . . . 0.0 109.876 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.569 ' HD2' HD22 ' A' ' 82' ' ' LEU . 1.7 m-85 -101.44 148.03 25.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.239 -0.913 . . . . 0.0 109.985 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.642 ' HB2' ' HD2' ' A' ' 31' ' ' ARG . . . -108.09 144.87 34.87 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.289 -0.882 . . . . 0.0 110.557 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 9.2 mttp -115.17 -56.4 2.37 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.224 -0.923 . . . . 0.0 110.122 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.3 mtt85 -141.39 72.95 1.4 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.565 ' O ' HG22 ' A' ' 26' ' ' VAL . . . -141.48 -176.2 15.61 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.693 -1.363 . . . . 0.0 109.693 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.459 ' HA ' HG22 ' A' ' 26' ' ' VAL . 34.9 m -140.22 116.16 10.35 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.154 -1.204 . . . . 0.0 110.235 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.19 133.3 24.36 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.163 -0.96 . . . . 0.0 110.71 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -76.62 123.33 6.66 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 109.449 -1.46 . . . . 0.0 109.449 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 16.2 t -61.4 127.78 33.14 Favored 'General case' 0 N--CA 1.508 2.425 0 O-C-N 121.266 -1.138 . . . . 0.0 109.483 179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 18.6 mmtt -61.51 147.94 43.69 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.188 -0.945 . . . . 0.0 109.201 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 54.21 44.24 29.4 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 120.872 -1.142 . . . . 0.0 109.468 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.4 t -165.87 149.65 7.92 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.374 -0.829 . . . . 0.0 110.692 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 tttt -101.09 51.27 0.85 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.308 -0.87 . . . . 0.0 108.678 178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -144.16 -174.99 4.44 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.453 -0.78 . . . . 0.0 110.339 -178.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 68.6 mttt -133.67 161.05 35.72 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.184 -0.947 . . . . 0.0 109.759 -179.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.822 HG23 ' CG1' ' A' ' 29' ' ' VAL . 51.7 mt -111.28 110.86 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.408 -0.808 . . . . 0.0 109.775 -179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 14' ' ' GLY . 57.5 t -141.04 103.54 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 O-C-N 121.134 -0.978 . . . . 0.0 111.455 -179.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.8 tttp 59.91 142.4 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.204 -0.935 . . . . 0.0 112.171 178.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.94 12.64 65.31 Favored Glycine 0 N--CA 1.497 2.754 0 O-C-N 121.088 -1.008 . . . . 0.0 111.841 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.822 ' CG1' HG23 ' A' ' 25' ' ' ILE . 84.0 t -128.77 136.65 59.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 CA-C-N 119.786 1.793 . . . . 0.0 110.486 -179.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.886 ' HB3' HD11 ' A' ' 53' ' ' ILE . 3.0 t -94.57 131.55 40.21 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.284 -0.885 . . . . 0.0 108.788 178.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 11' ' ' ALA . 8.7 mtp180 -106.52 129.31 54.49 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.149 -0.969 . . . . 0.0 110.719 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.544 HG23 HG12 ' A' ' 8' ' ' VAL . 12.2 mt -104.31 127.11 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 N-CA-C 108.504 -0.925 . . . . 0.0 108.504 179.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.91 126.97 9.07 Favored Glycine 0 N--CA 1.492 2.368 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 -179.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.422 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.7 ttpm? -103.44 107.83 18.83 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.365 -1.079 . . . . 0.0 109.331 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.7 t -102.03 107.86 22.58 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.161 -0.962 . . . . 0.0 110.605 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.634 HG12 ' HA ' ' A' ' 4' ' ' GLN . 34.4 m -123.57 146.22 49.4 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.282 -0.886 . . . . 0.0 109.778 179.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -76.04 135.62 17.42 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.224 1.118 . . . . 0.0 110.353 -179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.9 t30 -103.36 143.17 26.08 Favored Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 121.182 -0.949 . . . . 0.0 109.886 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.54 71.36 3.19 Favored 'Trans proline' 0 N--CA 1.486 1.033 0 O-C-N 123.255 1.134 . . . . 0.0 110.213 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -148.0 -58.83 0.25 Allowed 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.16 -0.962 . . . . 0.0 110.495 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -113.13 155.75 24.41 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.127 -0.983 . . . . 0.0 110.239 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -97.86 -36.77 10.07 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.221 -0.924 . . . . 0.0 110.772 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.0 m -87.37 -40.18 14.65 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.932 -1.105 . . . . 0.0 110.04 179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -128.45 82.98 0.33 Allowed Glycine 0 N--CA 1.494 2.517 0 N-CA-C 109.426 -1.47 . . . . 0.0 109.426 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -136.91 59.56 0.63 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 109.722 -1.351 . . . . 0.0 109.722 -179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -134.32 142.21 47.18 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.239 -1.153 . . . . 0.0 110.039 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 34.8 mtp -117.71 137.09 52.92 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.117 -0.989 . . . . 0.0 110.618 -179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.2 ttmt -131.56 129.11 40.56 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.15 -0.969 . . . . 0.0 110.218 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -132.84 155.01 49.76 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.206 -0.934 . . . . 0.0 109.888 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -98.49 163.37 12.71 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.115 -0.99 . . . . 0.0 110.006 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -145.71 172.37 13.39 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.227 -0.92 . . . . 0.0 110.596 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -94.77 -172.27 2.68 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 108.782 -0.821 . . . . 0.0 108.782 178.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.941 HG22 ' CE1' ' A' ' 93' ' ' HIS . 45.2 mm -86.72 -40.07 13.81 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.088 0 O-C-N 121.021 -1.049 . . . . 0.0 108.999 178.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.8 tttm -89.32 -24.47 22.0 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 120.864 -1.148 . . . . 0.0 111.012 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 61.4 m -75.17 -44.87 44.3 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 120.734 -1.229 . . . . 0.0 110.01 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.17 -37.66 69.3 Favored 'General case' 0 N--CA 1.504 2.264 0 C-N-CA 119.477 -0.889 . . . . 0.0 109.919 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.451 ' CE1' HG13 ' A' ' 94' ' ' ILE . 8.0 m-85 -74.08 -31.8 62.98 Favored 'General case' 0 N--CA 1.503 2.183 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.417 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -63.08 -37.75 88.44 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.002 -1.061 . . . . 0.0 109.531 178.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.425 ' O ' ' HB2' ' A' ' 63' ' ' ALA . 7.0 tttp -58.71 -39.56 81.14 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.117 -0.989 . . . . 0.0 109.849 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.3 mp -59.35 -43.33 92.81 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.264 -0.898 . . . . 0.0 109.299 179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -59.23 -36.16 74.95 Favored 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.282 -0.886 . . . . 0.0 109.513 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.3 mmt-85 -105.86 31.28 5.15 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.241 -0.912 . . . . 0.0 110.561 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.425 ' HB2' ' O ' ' A' ' 59' ' ' LYS . . . -109.11 168.6 9.26 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.907 -1.121 . . . . 0.0 110.109 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.4 mtm-85 -80.62 157.08 26.09 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.28 -0.888 . . . . 0.0 110.243 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -78.46 -33.7 48.21 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.163 -0.961 . . . . 0.0 110.542 179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.0 m -50.9 -35.93 35.53 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 120.943 -1.098 . . . . 0.0 110.869 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -110.51 147.4 34.21 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.102 -0.999 . . . . 0.0 110.011 179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -133.97 145.51 49.59 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.196 -0.94 . . . . 0.0 110.393 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 22.9 mtmm -131.04 148.96 52.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.168 -0.958 . . . . 0.0 110.218 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.691 HG23 HD11 ' A' ' 76' ' ' LEU . 76.4 mt 53.78 97.97 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.091 -1.006 . . . . 0.0 110.809 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 33.3 mm-40 -113.32 133.76 54.96 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.197 -0.939 . . . . 0.0 109.692 179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 53.08 -170.54 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.958 -1.089 . . . . 0.0 110.333 -179.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.492 HD21 ' HG2' ' A' ' 87' ' ' LYS . 27.5 tp -108.39 -58.58 1.98 Allowed 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.081 -1.012 . . . . 0.0 110.051 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -58.5 -33.74 70.16 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.166 -0.959 . . . . 0.0 110.544 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -49.07 -33.78 12.26 Favored 'General case' 0 N--CA 1.514 2.753 0 O-C-N 120.989 -1.07 . . . . 0.0 111.462 -179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.697 HD22 ' HB3' ' A' ' 6' ' ' PHE . 54.7 mt -82.65 152.38 25.88 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.008 -1.058 . . . . 0.0 109.994 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -92.75 136.58 33.11 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.266 -0.896 . . . . 0.0 110.572 -179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 136.75 -47.49 0.96 Allowed Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.512 ' HA ' HD12 ' A' ' 82' ' ' LEU . 54.7 p-90 -50.48 -30.24 12.3 Favored 'General case' 0 N--CA 1.516 2.831 0 O-C-N 121.15 -1.206 . . . . 0.0 111.449 -179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.444 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 6.4 tm-20 -52.52 -28.85 22.29 Favored 'General case' 0 N--CA 1.511 2.609 0 O-C-N 120.883 -1.136 . . . . 0.0 111.28 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -113.06 29.31 8.08 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 120.95 -1.094 . . . . 0.0 111.788 -179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.569 HD22 ' HD2' ' A' ' 10' ' ' TYR . 33.3 mt -113.28 -165.85 1.03 Allowed 'General case' 0 N--CA 1.495 1.825 0 O-C-N 120.854 -1.154 . . . . 0.0 109.799 179.29 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -100.78 162.21 13.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.049 -1.032 . . . . 0.0 110.068 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -79.12 -39.77 32.77 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.202 -0.936 . . . . 0.0 110.294 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -69.19 -41.42 77.16 Favored 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.159 -0.963 . . . . 0.0 109.501 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.87 -39.15 73.05 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.331 -0.948 . . . . 0.0 108.918 178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.579 ' HA ' HD12 ' A' ' 90' ' ' ILE . 7.1 ttpt -61.11 -39.23 89.2 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.171 -0.955 . . . . 0.0 109.531 178.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -56.93 -34.9 68.43 Favored 'General case' 0 N--CA 1.509 2.495 0 O-C-N 121.141 -0.974 . . . . 0.0 110.212 179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -58.12 -39.41 78.63 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 121.128 -0.983 . . . . 0.0 110.16 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 87' ' ' LYS . 10.9 mt -66.29 -40.88 87.96 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.401 0 O-C-N 121.176 -0.953 . . . . 0.0 109.219 179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 71.1 m -58.9 -37.89 77.65 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.256 -0.903 . . . . 0.0 110.0 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -58.9 -40.47 84.58 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.154 -0.966 . . . . 0.0 109.822 179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.941 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.7 m-70 -60.38 -49.66 76.7 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.155 -0.966 . . . . 0.0 109.75 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.451 HG13 ' CE1' ' A' ' 57' ' ' PHE . 13.9 mt -63.79 -39.4 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.215 -0.928 . . . . 0.0 109.565 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.18 -40.7 98.27 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.142 -0.974 . . . . 0.0 109.341 179.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -71.86 -38.3 70.08 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.261 -0.9 . . . . 0.0 109.226 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 20.0 tp -72.95 -37.34 67.16 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.271 -0.893 . . . . 0.0 109.951 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 5.2 m -65.28 -51.47 60.57 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.098 -1.001 . . . . 0.0 109.991 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.07 118.56 30.92 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.173 -0.955 . . . . 0.0 110.305 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.5 tttt -143.44 -59.7 0.41 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.212 -0.93 . . . . 0.0 110.186 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 52.69 61.44 3.19 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.011 -1.056 . . . . 0.0 110.684 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.27 46.8 2.02 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.099 -1.001 . . . . 0.0 110.217 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -131.04 -63.5 0.09 OUTLIER Glycine 0 N--CA 1.493 2.468 0 N-CA-C 109.549 -1.42 . . . . 0.0 109.549 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 59.5 m 52.57 73.49 0.94 Allowed Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 121.025 -1.28 . . . . 0.0 110.809 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.13 -173.78 1.37 Allowed 'Trans proline' 0 C--N 1.317 -1.09 0 O-C-N 123.301 1.158 . . . . 0.0 110.391 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -131.78 -60.18 0.93 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.176 -0.952 . . . . 0.0 110.313 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 16.8 mtpp -136.44 147.54 47.27 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.188 -0.945 . . . . 0.0 110.31 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttp -127.62 89.82 3.01 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.279 -0.888 . . . . 0.0 110.164 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -126.08 167.59 15.15 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.247 -0.908 . . . . 0.0 110.207 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 57.4 t -111.65 121.87 64.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.209 -0.932 . . . . 0.0 110.03 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.2 t -129.68 143.83 39.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.161 -0.962 . . . . 0.0 109.954 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 14.0 mt-30 -113.05 116.93 30.68 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.196 -0.94 . . . . 0.0 110.12 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.1 142.25 47.62 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.108 -0.995 . . . . 0.0 110.268 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -111.4 117.69 33.77 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.208 -0.933 . . . . 0.0 110.222 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.0 tp -117.13 141.76 47.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.225 -0.922 . . . . 0.0 110.251 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 m -131.99 100.28 5.01 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.161 -0.962 . . . . 0.0 110.291 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.131 0 O-C-N 121.06 -1.025 . . . . 0.0 110.778 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 ttt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 120.679 0.276 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -116.88 95.58 5.08 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.2 -0.938 . . . . 0.0 110.242 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -117.55 131.33 56.71 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.225 -0.922 . . . . 0.0 110.202 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -141.33 135.44 30.53 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.195 -0.941 . . . . 0.0 110.222 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 15.9 ttt85 -124.51 131.61 53.49 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.266 -0.896 . . . . 0.0 110.185 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.718 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.5 m-85 -125.15 136.76 53.93 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.153 -0.967 . . . . 0.0 110.275 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.412 ' O ' HG23 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -121.89 164.12 18.09 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.243 -0.91 . . . . 0.0 109.062 179.316 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.479 HG13 ' HB3' ' A' ' 76' ' ' LEU . 25.4 m -130.95 134.98 60.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.945 -1.097 . . . . 0.0 110.465 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -139.67 156.69 46.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.151 -0.968 . . . . 0.0 110.2 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.622 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.5 OUTLIER -105.97 156.15 18.66 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.366 -0.834 . . . . 0.0 110.069 179.929 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.725 ' HB1' ' HA ' ' A' ' 26' ' ' VAL . . . -103.05 102.67 12.71 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.261 -0.899 . . . . 0.0 110.503 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -115.13 -56.21 2.39 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.303 -0.873 . . . . 0.0 109.94 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 5.7 tpt85 -114.91 83.19 1.86 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.202 -0.936 . . . . 0.0 110.029 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.675 ' O ' HG23 ' A' ' 26' ' ' VAL . . . 142.08 170.47 12.57 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.6 t -143.91 140.84 29.94 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.175 -1.191 . . . . 0.0 110.531 -179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.03 147.38 51.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.249 -0.907 . . . . 0.0 110.471 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -78.43 122.05 5.83 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.499 ' CA ' HD11 ' A' ' 25' ' ' ILE . 7.1 t -64.49 124.54 22.1 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.177 -1.19 . . . . 0.0 109.447 179.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.15 148.54 40.32 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 120.999 -1.063 . . . . 0.0 108.939 179.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 mttm 52.85 64.1 1.99 Allowed 'General case' 0 N--CA 1.505 2.276 0 O-C-N 120.982 -1.074 . . . . 0.0 108.984 -178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.5 t -172.98 -44.45 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.246 0 O-C-N 121.264 -0.897 . . . . 0.0 112.54 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.5 ttmt 70.08 44.15 0.81 Allowed 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.935 -1.103 . . . . 0.0 108.341 -177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -141.05 -170.05 2.96 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.539 -0.726 . . . . 0.0 109.364 -179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 89.5 mttt -127.6 156.02 42.93 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.883 -1.135 . . . . 0.0 110.92 -178.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.905 HG23 ' CG1' ' A' ' 29' ' ' VAL . 15.8 mt -120.09 104.2 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -0.757 . . . . 0.0 109.615 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.725 ' HA ' ' HB1' ' A' ' 11' ' ' ALA . 10.1 p -163.84 147.59 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.084 -1.01 . . . . 0.0 111.578 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.9 mtmt 53.94 102.82 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.381 -0.824 . . . . 0.0 111.664 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.22 11.28 85.05 Favored Glycine 0 N--CA 1.494 2.549 0 C-N-CA 120.145 -1.026 . . . . 0.0 112.012 178.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.905 ' CG1' HG23 ' A' ' 25' ' ' ILE . 93.1 t -121.78 135.2 62.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 CA-C-N 119.87 1.835 . . . . 0.0 110.634 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.889 ' HB3' HD11 ' A' ' 53' ' ' ILE . 1.7 t -105.75 141.19 37.61 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.26 -0.9 . . . . 0.0 108.829 178.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.631 ' HB3' HG21 ' A' ' 25' ' ' ILE . 3.2 ptp180 -122.21 144.66 48.83 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.154 -0.966 . . . . 0.0 111.408 -179.222 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 7' ' ' CYS . 17.6 mt -107.16 137.51 37.77 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.339 -0.851 . . . . 0.0 109.412 179.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.446 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.32 128.2 9.39 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.164 -1.575 . . . . 0.0 109.164 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 30.0 tttt -112.23 117.53 32.79 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.192 -1.181 . . . . 0.0 109.973 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.8 t -100.55 109.04 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.072 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.3 t -120.79 124.38 27.54 Favored Pre-proline 0 N--CA 1.493 1.723 0 O-C-N 121.174 -0.954 . . . . 0.0 109.773 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.85 142.58 35.47 Favored 'Trans proline' 0 N--CA 1.486 1.049 0 O-C-N 123.146 1.077 . . . . 0.0 110.452 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -103.47 154.23 37.98 Favored Pre-proline 0 N--CA 1.499 2.003 0 O-C-N 121.16 -0.963 . . . . 0.0 110.216 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.8 70.11 4.38 Favored 'Trans proline' 0 C--N 1.316 -1.161 0 O-C-N 123.434 1.228 . . . . 0.0 110.463 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 27.4 t80 -152.9 -58.37 0.14 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.09 -1.006 . . . . 0.0 110.418 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -112.5 156.84 21.93 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.201 -0.937 . . . . 0.0 110.079 179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -101.31 -48.02 4.51 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.141 -0.975 . . . . 0.0 110.31 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 61.3 p -88.86 -39.88 13.52 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.15 -0.969 . . . . 0.0 110.268 179.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -111.57 65.89 0.25 Allowed Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.65 72.63 0.36 Allowed Glycine 0 N--CA 1.495 2.609 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -146.09 135.11 22.63 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.16 -1.2 . . . . 0.0 110.351 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.5 mtp -117.62 141.52 48.28 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.194 -0.941 . . . . 0.0 110.366 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 8.3 ttmm -130.42 127.71 39.86 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.132 -0.98 . . . . 0.0 110.25 179.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -124.92 153.57 42.47 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.122 -0.986 . . . . 0.0 110.088 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 56.6 m95 -105.98 129.6 54.07 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.194 -0.941 . . . . 0.0 109.949 179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -112.41 177.11 4.75 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.21 -0.931 . . . . 0.0 111.162 -179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.447 ' CD2' HG12 ' A' ' 25' ' ' ILE . 0.4 OUTLIER -94.69 -170.68 2.29 Favored 'General case' 0 N--CA 1.502 2.153 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.519 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.98 HG22 ' CE1' ' A' ' 93' ' ' HIS . 46.3 mm -88.3 -43.6 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 O-C-N 121.044 -1.035 . . . . 0.0 108.982 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.17 -21.95 27.27 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.993 -1.067 . . . . 0.0 111.399 179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 63.0 m -75.38 -43.68 48.94 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.683 -1.261 . . . . 0.0 110.092 179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 10.2 tpt -73.59 -39.33 64.7 Favored 'General case' 0 N--CA 1.505 2.297 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.733 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.666 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 10.1 m-85 -73.32 -30.21 63.21 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.193 -1.003 . . . . 0.0 109.967 179.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -67.42 -36.83 82.03 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.927 -1.108 . . . . 0.0 109.403 178.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -58.5 -38.64 78.09 Favored 'General case' 0 N--CA 1.51 2.546 0 O-C-N 120.991 -1.068 . . . . 0.0 109.888 179.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.2 -41.33 86.0 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.746 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -67.01 -33.58 75.87 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.3 -0.875 . . . . 0.0 110.647 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 18.2 ttt85 -86.5 -35.88 19.34 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.12 -0.988 . . . . 0.0 110.42 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -113.3 127.98 56.32 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.045 -1.034 . . . . 0.0 110.061 179.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 14.6 mtt85 -112.57 101.24 9.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.162 -0.961 . . . . 0.0 110.249 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -90.38 4.06 51.98 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.267 -0.895 . . . . 0.0 111.881 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 8.6 m 56.02 36.34 27.19 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.467 -1.396 . . . . 0.0 110.349 -179.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 58.8 m -117.56 161.72 19.17 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.199 -0.938 . . . . 0.0 109.92 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.3 tppt? -97.37 95.02 7.4 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.213 -0.929 . . . . 0.0 109.976 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -123.54 135.04 53.8 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.239 -0.913 . . . . 0.0 110.143 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.778 HG12 HD11 ' A' ' 76' ' ' LEU . 77.5 mt 52.84 94.71 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.048 -1.033 . . . . 0.0 110.589 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -115.22 135.4 54.21 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.19 -0.944 . . . . 0.0 109.966 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.2 t0 53.46 -165.25 0.08 Allowed 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.1 -1.0 . . . . 0.0 110.542 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.551 HD13 ' HB ' ' A' ' 91' ' ' THR . 8.3 tt -103.68 -48.12 4.04 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.171 -0.955 . . . . 0.0 110.354 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.31 69.62 4.54 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.125 -0.985 . . . . 0.0 109.817 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -143.49 -58.6 0.41 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.267 -0.896 . . . . 0.0 110.07 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.778 HD11 HG12 ' A' ' 70' ' ' ILE . 94.3 mt -62.52 151.59 37.12 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.163 -0.961 . . . . 0.0 109.564 179.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 50.4 tt0 -79.94 128.84 33.95 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.184 -0.948 . . . . 0.0 110.262 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 143.71 -47.62 0.78 Allowed Glycine 0 N--CA 1.494 2.505 0 C-N-CA 119.753 -1.213 . . . . 0.0 110.588 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.45 ' HA ' HD12 ' A' ' 82' ' ' LEU . 45.9 p-90 -51.7 -30.54 22.51 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.917 -1.343 . . . . 0.0 111.216 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 5.8 tp10 -53.76 -27.91 31.45 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 120.963 -1.086 . . . . 0.0 111.332 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -111.74 26.95 10.11 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 120.821 -1.174 . . . . 0.0 112.064 -179.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.622 HD13 ' CD2' ' A' ' 10' ' ' TYR . 29.9 mt -108.81 -164.27 0.93 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.812 -1.18 . . . . 0.0 109.555 179.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.3 mp0 -94.98 161.89 13.96 Favored 'General case' 0 N--CA 1.504 2.255 0 O-C-N 120.957 -1.09 . . . . 0.0 110.512 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -76.36 -47.9 21.79 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.238 -0.914 . . . . 0.0 109.999 179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -60.3 -41.65 93.88 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.236 -0.915 . . . . 0.0 109.594 179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.427 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 15.3 mt-10 -59.46 -39.98 85.4 Favored 'General case' 0 N--CA 1.508 2.475 0 O-C-N 121.291 -0.881 . . . . 0.0 109.628 179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.871 ' HA ' HD12 ' A' ' 90' ' ' ILE . 3.6 ttpp -56.39 -39.23 72.63 Favored 'General case' 0 N--CA 1.51 2.554 0 O-C-N 121.207 -0.933 . . . . 0.0 109.97 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.536 ' O ' HG22 ' A' ' 91' ' ' THR . 3.1 tt0 -57.88 -37.92 74.82 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.263 -0.898 . . . . 0.0 109.961 179.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -70.07 -33.72 72.28 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.122 -0.986 . . . . 0.0 110.031 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.871 HD12 ' HA ' ' A' ' 87' ' ' LYS . 11.9 mt -70.37 -38.64 74.78 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.365 0 O-C-N 121.11 -0.994 . . . . 0.0 110.003 179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.551 ' HB ' HD13 ' A' ' 73' ' ' LEU . 9.5 t -69.04 -32.42 71.9 Favored 'General case' 0 N--CA 1.509 2.494 0 C-N-CA 118.913 -1.115 . . . . 0.0 110.276 179.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -71.58 -39.89 70.29 Favored 'General case' 0 N--CA 1.505 2.31 0 O-C-N 120.992 -1.067 . . . . 0.0 108.781 178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.98 ' CE1' HG22 ' A' ' 53' ' ' ILE . 70.0 t60 -56.27 -43.79 79.12 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 121.268 -0.895 . . . . 0.0 109.721 179.265 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.468 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 58.0 mt -67.94 -39.68 82.09 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.397 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.905 178.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.74 -38.43 85.12 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.16 -0.963 . . . . 0.0 109.681 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -60.35 -42.29 95.41 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.16 -0.963 . . . . 0.0 109.377 179.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.4 HD22 ' HD1' ' A' ' 57' ' ' PHE . 5.6 tp -66.07 -35.86 81.65 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.297 -0.877 . . . . 0.0 109.859 179.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 73.6 m -105.09 58.6 0.68 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.156 -0.965 . . . . 0.0 109.971 179.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 6.1 t -129.91 62.41 1.55 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.091 -1.006 . . . . 0.0 110.283 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 16.3 mttm -143.32 40.06 1.45 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.098 -1.001 . . . . 0.0 110.232 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.58 41.9 1.59 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.2 -0.938 . . . . 0.0 110.215 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.55 120.14 11.78 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.179 -0.95 . . . . 0.0 110.283 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 63.48 173.66 2.62 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 2.1 m -136.21 85.31 27.7 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.197 -1.178 . . . . 0.0 110.201 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.43 171.19 17.55 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 O-C-N 123.351 1.185 . . . . 0.0 110.433 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.5 mtmt -117.55 -57.27 2.14 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.227 -0.921 . . . . 0.0 110.222 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.5 mmtm -117.42 134.53 54.73 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.246 -0.909 . . . . 0.0 110.273 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.34 60.47 1.7 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.173 -0.954 . . . . 0.0 110.247 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.68 138.36 51.51 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.139 -0.976 . . . . 0.0 110.204 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.64 148.49 33.1 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.235 -0.916 . . . . 0.0 110.206 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.3 t -113.96 130.3 68.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 O-C-N 121.235 -0.915 . . . . 0.0 110.021 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -117.45 135.09 54.14 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.155 -0.966 . . . . 0.0 110.272 179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.34 129.26 55.76 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.16 -0.962 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 13.0 mttt -117.31 136.74 52.91 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.231 -0.918 . . . . 0.0 110.218 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 5.0 tp -117.96 144.88 45.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.214 -0.928 . . . . 0.0 110.248 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 35.3 p -117.89 109.48 16.58 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.177 -0.952 . . . . 0.0 110.195 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 34.7 m . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.192 179.975 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 ttm . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.19 40.25 2.88 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.163 -0.961 . . . . 0.0 110.238 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -144.65 136.44 25.79 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.156 -0.965 . . . . 0.0 110.341 -179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -144.96 151.69 39.03 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.21 -0.932 . . . . 0.0 110.322 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.3 mmt85 -139.69 131.85 28.09 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.235 -0.916 . . . . 0.0 110.215 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.808 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.1 m-85 -125.4 139.95 53.22 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.166 -0.959 . . . . 0.0 110.25 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 78.5 m -127.39 163.19 24.58 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.227 -0.921 . . . . 0.0 108.871 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.643 HG12 HG23 ' A' ' 32' ' ' ILE . 29.2 m -133.76 133.29 56.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 120.95 -1.094 . . . . 0.0 110.753 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -139.3 155.28 47.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.307 -0.871 . . . . 0.0 109.989 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -102.11 143.15 32.29 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.31 -0.869 . . . . 0.0 109.884 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.31 138.38 56.47 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.156 -0.965 . . . . 0.0 110.146 -179.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.6 mttt -130.05 -59.8 1.04 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.212 -0.93 . . . . 0.0 110.334 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.01 93.31 2.38 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.199 -0.938 . . . . 0.0 110.422 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.9 142.97 4.23 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.713 -1.355 . . . . 0.0 109.713 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.525 HG22 ' HA ' ' A' ' 26' ' ' VAL . 29.8 p -114.69 147.01 40.24 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.259 -1.142 . . . . 0.0 109.921 179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.62 147.79 38.15 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.089 -1.007 . . . . 0.0 111.003 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.94 124.88 18.23 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.668 -1.373 . . . . 0.0 109.668 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 9.1 t -61.36 131.05 49.03 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.221 -1.164 . . . . 0.0 109.344 179.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm -62.22 148.17 45.57 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.156 -0.965 . . . . 0.0 109.269 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.7 mttt 52.45 47.42 24.75 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 120.972 -1.08 . . . . 0.0 109.673 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 39.3 t -164.8 153.03 12.06 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.31 -0.869 . . . . 0.0 110.895 -178.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.2 tttm -103.84 46.96 0.89 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 178.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -142.05 -174.37 4.07 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.404 -0.81 . . . . 0.0 110.197 -178.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.7 pttt -133.2 156.27 47.82 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.222 -0.924 . . . . 0.0 109.727 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.731 HG21 ' HD3' ' A' ' 31' ' ' ARG . 62.2 mt -96.35 113.04 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.81 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.525 ' HA ' HG22 ' A' ' 15' ' ' THR . 67.9 t -108.51 162.78 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.984 0 O-C-N 121.267 -0.896 . . . . 0.0 109.767 -179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -41.44 133.15 2.59 Favored 'General case' 0 N--CA 1.519 3.02 0 O-C-N 121.689 -0.632 . . . . 0.0 111.527 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.8 4.31 45.61 Favored Glycine 0 N--CA 1.493 2.453 0 C-N-CA 120.311 -0.947 . . . . 0.0 111.084 -178.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.424 ' CG1' HG23 ' A' ' 25' ' ' ILE . 89.3 t -115.11 134.79 57.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 CA-C-N 119.582 1.691 . . . . 0.0 109.546 179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.706 ' HB3' HD11 ' A' ' 53' ' ' ILE . 44.9 t -85.39 134.41 34.08 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.169 -0.957 . . . . 0.0 108.933 178.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.731 ' HD3' HG21 ' A' ' 25' ' ' ILE . 46.1 mtm105 -115.43 135.48 54.07 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.177 -0.952 . . . . 0.0 111.275 -178.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.643 HG23 HG12 ' A' ' 8' ' ' VAL . 12.9 mt -104.7 129.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 178.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.1 131.71 10.7 Favored Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.755 -1.338 . . . . 0.0 109.755 -179.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 22.7 tttt -110.78 113.45 26.06 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.327 -1.102 . . . . 0.0 109.566 179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.2 t -92.73 107.62 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.148 -0.97 . . . . 0.0 110.198 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.407 HG13 ' O ' ' A' ' 36' ' ' VAL . 7.2 p -124.08 127.17 25.45 Favored Pre-proline 0 N--CA 1.495 1.818 0 O-C-N 121.282 -0.886 . . . . 0.0 110.193 179.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -73.63 139.05 27.62 Favored 'Trans proline' 0 C--N 1.319 -0.983 0 O-C-N 123.088 1.046 . . . . 0.0 110.514 -179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -103.44 118.74 56.94 Favored Pre-proline 0 N--CA 1.5 2.061 0 O-C-N 121.285 -0.885 . . . . 0.0 109.95 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -73.1 80.13 1.91 Allowed 'Trans proline' 0 N--CA 1.486 1.036 0 O-C-N 123.078 1.041 . . . . 0.0 110.588 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -149.95 -58.69 0.19 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.238 -0.914 . . . . 0.0 110.433 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.92 156.67 20.85 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.189 -0.944 . . . . 0.0 110.18 179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -97.8 -39.84 8.83 Favored 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.216 -0.927 . . . . 0.0 110.634 -179.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 70.7 m -55.71 -38.68 70.04 Favored 'General case' 0 N--CA 1.512 2.625 0 O-C-N 120.987 -1.071 . . . . 0.0 110.395 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -71.81 -175.92 25.02 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -141.37 -95.71 0.26 Allowed Glycine 0 N--CA 1.493 2.499 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -130.82 146.59 52.31 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.193 -1.18 . . . . 0.0 110.25 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.2 ttm -115.66 149.08 38.93 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.211 -0.931 . . . . 0.0 110.191 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -129.23 148.75 51.2 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.552 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -132.47 155.28 48.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.57 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 71.0 m95 -98.13 156.87 16.47 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.122 -0.986 . . . . 0.0 110.157 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -136.15 172.99 12.2 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.317 -0.864 . . . . 0.0 110.546 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 55' ' ' CYS . 0.3 OUTLIER -91.72 -170.42 2.58 Favored 'General case' 0 N--CA 1.504 2.232 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.585 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.842 HG22 ' CE1' ' A' ' 93' ' ' HIS . 42.1 mm -83.89 -60.02 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 C-N-CA 119.134 -1.026 . . . . 0.0 109.161 179.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.424 ' HE2' ' CE1' ' A' ' 93' ' ' HIS . 23.7 mmtt -73.82 -27.42 61.11 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.927 -1.108 . . . . 0.0 111.262 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.403 ' HB2' ' HB2' ' A' ' 52' ' ' HIS . 84.5 m -65.87 -51.47 58.45 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 120.741 -1.224 . . . . 0.0 110.253 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.671 ' HE1' HD11 ' A' ' 70' ' ' ILE . 0.6 OUTLIER -70.05 -39.55 75.65 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.406 -0.918 . . . . 0.0 109.814 -179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.458 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 8.6 m-85 -71.85 -28.56 63.63 Favored 'General case' 0 N--CA 1.505 2.325 0 C-N-CA 119.2 -1.0 . . . . 0.0 109.944 178.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 24.8 tp10 -67.38 -37.01 82.48 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.789 -1.194 . . . . 0.0 109.43 178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 20.5 tttm -58.58 -40.49 83.29 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.023 -1.048 . . . . 0.0 109.755 179.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.8 mp -61.22 -42.17 98.14 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.227 -0.921 . . . . 0.0 109.129 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -56.71 -33.83 66.88 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.152 -0.968 . . . . 0.0 109.67 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.8 mtt-85 -103.35 29.84 5.34 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.215 -0.928 . . . . 0.0 110.497 179.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.0 168.61 9.3 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.882 -1.136 . . . . 0.0 109.976 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.3 mtp-105 -63.1 152.14 38.03 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 121.164 -0.96 . . . . 0.0 110.096 -179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.96 -33.76 19.54 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.188 -0.945 . . . . 0.0 110.742 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 3.9 p -49.73 -34.72 19.73 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 120.931 -1.106 . . . . 0.0 111.187 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.2 p -109.6 139.92 44.03 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.037 -1.039 . . . . 0.0 110.164 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.2 mmtt -114.94 144.41 43.62 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.225 -0.922 . . . . 0.0 110.136 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -123.24 136.71 54.84 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.204 -0.935 . . . . 0.0 110.461 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.671 HD11 ' HE1' ' A' ' 56' ' ' MET . 83.4 mt 54.54 101.03 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.219 -0.926 . . . . 0.0 110.949 179.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -110.23 141.17 43.55 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.158 -0.964 . . . . 0.0 109.789 179.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.6 t0 53.41 -169.9 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 121.035 -1.041 . . . . 0.0 110.416 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.536 ' HB2' HG23 ' A' ' 91' ' ' THR . 18.7 tp -118.52 38.58 3.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.105 -0.997 . . . . 0.0 110.648 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 35.98 0.82 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.132 -0.98 . . . . 0.0 110.55 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -131.43 29.45 4.57 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.201 -0.937 . . . . 0.0 110.559 179.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.808 HD22 ' HB3' ' A' ' 6' ' ' PHE . 96.4 mt -137.46 153.57 50.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.045 -1.034 . . . . 0.0 109.401 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -82.8 102.24 11.47 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.07 -1.018 . . . . 0.0 110.393 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 155.93 -39.11 0.6 Allowed Glycine 0 N--CA 1.497 2.735 0 C-N-CA 119.674 -1.25 . . . . 0.0 111.105 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.403 ' N ' ' CG2' ' A' ' 8' ' ' VAL . 46.6 p-90 -57.26 -32.17 66.32 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 120.832 -1.393 . . . . 0.0 110.913 -179.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -53.26 -34.27 56.5 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.832 -1.167 . . . . 0.0 110.612 179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.86 -36.06 31.89 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 120.999 -1.063 . . . . 0.0 110.295 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.02 176.91 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.965 -1.084 . . . . 0.0 110.66 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -104.02 160.4 14.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.078 -1.014 . . . . 0.0 110.406 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -60.44 -46.01 91.59 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.238 -0.914 . . . . 0.0 110.086 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -61.56 -48.04 82.79 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.47 -0.892 . . . . 0.0 109.553 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -64.66 -40.59 95.69 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.429 -0.909 . . . . 0.0 109.197 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.408 ' O ' ' OG1' ' A' ' 91' ' ' THR . 12.5 tttm -62.3 -38.9 91.17 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.347 -0.846 . . . . 0.0 109.911 179.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -62.07 -41.12 97.84 Favored 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.196 -0.94 . . . . 0.0 109.893 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 35.7 mt-30 -66.89 -38.04 85.53 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.244 -0.91 . . . . 0.0 110.081 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 45.7 mm -67.14 -38.5 81.26 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.298 0 O-C-N 121.124 -0.985 . . . . 0.0 109.338 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.536 HG23 ' HB2' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -59.24 -39.03 81.47 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 121.135 -0.978 . . . . 0.0 109.811 179.472 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -56.02 -36.76 68.33 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.191 -0.943 . . . . 0.0 110.063 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.842 ' CE1' HG22 ' A' ' 53' ' ' ILE . 0.2 OUTLIER -58.82 -51.61 69.26 Favored 'General case' 0 N--CA 1.512 2.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.677 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.458 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.2 mt -60.79 -37.59 76.66 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.487 0 O-C-N 121.225 -0.922 . . . . 0.0 109.704 179.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.56 -40.09 86.18 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.168 -0.957 . . . . 0.0 109.62 179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -68.37 -43.35 77.56 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.232 -0.917 . . . . 0.0 108.791 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.9 tp -63.73 -35.06 79.34 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 121.315 -0.865 . . . . 0.0 109.77 179.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.3 m -100.62 66.59 1.23 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.981 -1.074 . . . . 0.0 110.092 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.3 t -138.34 165.89 25.61 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.126 -0.984 . . . . 0.0 110.177 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -138.94 -175.74 4.25 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.279 -0.888 . . . . 0.0 110.15 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -121.05 112.12 18.31 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.167 -0.958 . . . . 0.0 110.242 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.92 48.07 1.81 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.297 -0.877 . . . . 0.0 110.226 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -103.3 -146.41 16.82 Favored Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.496 -1.441 . . . . 0.0 109.496 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 36.1 m -130.8 95.75 25.05 Favored Pre-proline 0 N--CA 1.494 1.753 0 O-C-N 121.233 -1.157 . . . . 0.0 110.185 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.8 161.4 43.89 Favored 'Trans proline' 0 C--N 1.317 -1.102 0 O-C-N 123.378 1.199 . . . . 0.0 110.41 179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 5.1 tttp 52.56 94.65 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.03 -1.044 . . . . 0.0 110.758 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 9.2 tttt -120.9 147.37 45.51 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.212 -0.93 . . . . 0.0 110.284 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.4 mtpp -124.13 145.22 49.42 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.168 -0.958 . . . . 0.0 110.201 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -120.63 166.99 12.9 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.186 -0.946 . . . . 0.0 110.198 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.9 t -116.63 101.44 12.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.225 -0.922 . . . . 0.0 109.986 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.9 t -122.53 109.56 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.321 -0.862 . . . . 0.0 110.0 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -118.53 128.59 54.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.181 -0.949 . . . . 0.0 110.137 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -133.87 127.2 32.06 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.185 -0.947 . . . . 0.0 110.294 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 2.6 pttt -126.05 150.72 47.94 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.178 -0.951 . . . . 0.0 110.294 179.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.9 tp -126.9 150.63 49.2 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.189 -0.944 . . . . 0.0 110.142 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.72 138.98 52.28 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.253 -0.905 . . . . 0.0 110.191 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.406 ' OXT' HG22 ' A' ' 117' ' ' THR . 5.8 m . . . . . 0 N--CA 1.502 2.172 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.733 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.4 mtp . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.95 161.41 20.93 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.221 -0.924 . . . . 0.0 110.316 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -124.38 127.43 47.55 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.228 -0.92 . . . . 0.0 110.089 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -133.72 159.48 40.44 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.153 -0.967 . . . . 0.0 110.337 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -142.2 137.86 31.08 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.217 -0.927 . . . . 0.0 110.191 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.718 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -117.25 142.13 47.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.175 -0.953 . . . . 0.0 110.207 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 82.9 m -130.51 165.0 23.61 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.262 -0.899 . . . . 0.0 109.314 179.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 33.8 m -130.64 139.83 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.066 -1.022 . . . . 0.0 110.641 179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -147.02 107.66 4.12 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.239 -0.913 . . . . 0.0 110.35 -179.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.791 ' CD2' HD13 ' A' ' 82' ' ' LEU . 10.5 m-85 -58.9 153.03 18.13 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 121.162 -0.961 . . . . 0.0 110.054 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -109.75 136.55 48.91 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.309 -0.869 . . . . 0.0 110.311 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.4 tptt -120.16 -57.34 1.94 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.253 -0.904 . . . . 0.0 110.306 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.9 mtm180 -128.24 122.99 33.06 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.097 -1.002 . . . . 0.0 110.161 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 138.98 170.88 11.96 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.815 HG23 ' CG1' ' A' ' 26' ' ' VAL . 57.4 m -140.98 135.44 31.17 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.18 -1.188 . . . . 0.0 110.126 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -144.44 137.17 26.8 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.16 -0.963 . . . . 0.0 110.734 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -68.6 123.21 15.73 Favored Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.71 -1.356 . . . . 0.0 109.71 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 13.6 t -62.37 130.9 47.39 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.246 -1.15 . . . . 0.0 109.46 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -62.41 147.33 48.89 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.15 -0.969 . . . . 0.0 109.117 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.1 mptp? 52.5 48.21 23.06 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.02 -1.05 . . . . 0.0 109.579 -179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.1 t -164.93 153.3 12.04 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.401 -0.812 . . . . 0.0 110.852 -178.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -104.05 46.27 0.92 Allowed 'General case' 0 N--CA 1.497 1.878 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 178.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -143.28 -174.63 4.26 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.498 -0.751 . . . . 0.0 110.077 -178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.5 mtmt -136.16 155.5 50.06 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.112 -0.993 . . . . 0.0 109.727 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.604 HG23 HG11 ' A' ' 29' ' ' VAL . 59.5 mt -103.86 118.29 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.303 -0.873 . . . . 0.0 109.709 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.815 ' CG1' HG23 ' A' ' 15' ' ' THR . 29.7 m -137.48 89.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.106 -0.996 . . . . 0.0 111.251 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 18.8 tttm 60.3 149.45 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.081 -1.012 . . . . 0.0 111.318 179.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.13 9.18 80.25 Favored Glycine 0 N--CA 1.496 2.678 0 C-N-CA 120.245 -0.978 . . . . 0.0 111.712 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.604 HG11 HG23 ' A' ' 25' ' ' ILE . 80.1 t -127.6 135.17 63.91 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 CA-C-N 119.712 1.756 . . . . 0.0 110.247 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.781 ' HB3' HD11 ' A' ' 53' ' ' ILE . 5.7 t -87.47 120.96 29.3 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 178.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.592 ' HD3' HG21 ' A' ' 25' ' ' ILE . 44.6 mtm180 -101.69 129.8 47.93 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.159 -0.963 . . . . 0.0 110.939 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.442 HD12 ' HG2' ' A' ' 56' ' ' MET . 18.9 mt -103.82 131.06 53.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.13 126.0 8.77 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.587 -1.405 . . . . 0.0 109.587 -179.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.419 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 40.4 tttt -107.48 116.99 32.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.289 -1.124 . . . . 0.0 109.741 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.8 t -106.87 111.96 37.83 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.097 -1.002 . . . . 0.0 110.106 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 73.7 t -120.37 113.64 33.63 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.247 -0.908 . . . . 0.0 109.794 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.8 Cg_endo -72.35 147.24 46.76 Favored 'Trans proline' 0 N--CA 1.485 1.018 0 O-C-N 123.202 1.106 . . . . 0.0 110.47 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -102.89 163.7 17.02 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.327 -0.858 . . . . 0.0 110.233 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -72.28 70.92 3.08 Favored 'Trans proline' 0 C--N 1.317 -1.085 0 O-C-N 123.357 1.188 . . . . 0.0 110.411 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -152.61 -58.27 0.14 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.127 -0.983 . . . . 0.0 110.428 -180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 30.4 t -108.97 157.52 18.57 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.264 -0.898 . . . . 0.0 110.173 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -99.48 -45.03 5.96 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.165 -0.959 . . . . 0.0 110.409 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.14 -40.39 13.79 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.13 -0.981 . . . . 0.0 110.032 179.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -110.58 -167.8 19.32 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.538 -1.425 . . . . 0.0 109.538 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 90.47 41.7 5.37 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.601 -1.399 . . . . 0.0 109.601 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -122.02 143.29 49.58 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.198 -1.177 . . . . 0.0 110.271 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.3 mmt -117.15 129.66 56.11 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.244 -0.91 . . . . 0.0 110.26 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 ttmt -122.99 136.0 54.69 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.239 -0.913 . . . . 0.0 110.226 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.9 mp0 -139.76 155.8 47.12 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.131 -0.981 . . . . 0.0 109.923 179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 51.8 m95 -98.11 163.01 12.92 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.185 -0.947 . . . . 0.0 110.138 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -143.66 172.69 12.47 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.265 -0.897 . . . . 0.0 110.683 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.409 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 1.9 m80 -91.71 -172.07 3.09 Favored 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 178.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.954 HG22 ' CE1' ' A' ' 93' ' ' HIS . 44.6 mm -83.38 -47.1 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.204 0 C-N-CA 119.117 -1.033 . . . . 0.0 109.047 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.7 mtmt -80.22 -32.89 38.42 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.798 -1.189 . . . . 0.0 110.717 179.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 70.8 m -62.67 -50.92 69.28 Favored 'General case' 0 N--CA 1.508 2.456 0 O-C-N 120.939 -1.101 . . . . 0.0 110.235 -179.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.442 ' HG2' HD12 ' A' ' 32' ' ' ILE . 10.0 tpt -68.0 -42.22 81.08 Favored 'General case' 0 N--CA 1.508 2.438 0 C-N-CA 119.405 -0.918 . . . . 0.0 109.842 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.65 ' HD1' HD22 ' A' ' 97' ' ' LEU . 9.8 m-85 -69.27 -30.71 68.88 Favored 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 119.063 -1.055 . . . . 0.0 109.647 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.61 -37.82 85.36 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 120.962 -1.086 . . . . 0.0 109.417 178.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -58.18 -39.19 78.26 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.027 -1.046 . . . . 0.0 109.903 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.7 mp -58.1 -41.78 84.28 Favored 'General case' 0 N--CA 1.51 2.55 0 O-C-N 121.154 -0.966 . . . . 0.0 109.346 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -57.95 -34.12 69.57 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.236 -0.915 . . . . 0.0 109.589 178.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 mmm180 -104.4 30.46 5.31 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.196 -0.94 . . . . 0.0 110.525 179.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -107.68 168.34 9.32 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.892 -1.13 . . . . 0.0 110.071 179.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -78.92 157.36 28.24 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 121.247 -0.908 . . . . 0.0 110.178 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -83.67 -33.41 25.21 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.257 -0.902 . . . . 0.0 110.707 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.42 -36.2 32.0 Favored 'General case' 0 N--CA 1.515 2.779 0 O-C-N 120.924 -1.11 . . . . 0.0 110.873 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.5 m -109.8 148.29 31.73 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.133 -0.979 . . . . 0.0 109.883 179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.4 tptt -116.39 139.54 50.32 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.161 -0.962 . . . . 0.0 110.478 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.69 130.41 56.32 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.178 -0.951 . . . . 0.0 109.918 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.576 HG23 HD11 ' A' ' 76' ' ' LEU . 73.4 mt 54.97 99.21 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.188 0 O-C-N 121.126 -0.984 . . . . 0.0 110.469 -179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -109.49 139.91 43.9 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.156 -0.965 . . . . 0.0 110.31 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.17 -176.73 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.092 -1.005 . . . . 0.0 110.896 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.871 HD11 HG23 ' A' ' 90' ' ' ILE . 15.0 tp -98.73 -29.65 12.89 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.25 42.88 1.08 Allowed 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.779 -1.201 . . . . 0.0 110.404 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -122.06 34.7 5.09 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.142 -0.974 . . . . 0.0 110.192 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.718 HD22 ' HB3' ' A' ' 6' ' ' PHE . 57.3 mt -145.8 153.71 41.22 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.05 -1.031 . . . . 0.0 109.963 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -85.13 116.37 23.46 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.046 -1.034 . . . . 0.0 110.442 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 148.49 -40.92 0.9 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 119.755 -1.212 . . . . 0.0 110.744 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.403 ' HA ' HD12 ' A' ' 82' ' ' LEU . 48.9 p-90 -61.93 -26.1 67.98 Favored 'General case' 0 N--CA 1.513 2.684 0 O-C-N 121.069 -1.253 . . . . 0.0 111.538 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -53.05 -28.04 22.75 Favored 'General case' 0 N--CA 1.511 2.578 0 O-C-N 120.788 -1.195 . . . . 0.0 111.465 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -112.77 28.45 8.78 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.809 -1.182 . . . . 0.0 112.116 -179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.791 HD13 ' CD2' ' A' ' 10' ' ' TYR . 25.8 mt -109.76 -166.1 1.07 Allowed 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.714 -1.242 . . . . 0.0 109.918 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -97.74 162.83 13.08 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.101 -0.999 . . . . 0.0 110.333 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 57.3 m-20 -81.96 -39.89 23.02 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.212 -0.93 . . . . 0.0 110.306 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -61.85 -50.54 71.86 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.19 -0.944 . . . . 0.0 109.596 179.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 10.7 mt-10 -61.75 -41.49 97.73 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.289 -0.882 . . . . 0.0 109.227 179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.562 ' O ' HG22 ' A' ' 90' ' ' ILE . 1.0 OUTLIER -59.17 -34.36 72.02 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.259 -0.901 . . . . 0.0 110.208 179.298 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.71 -35.3 76.99 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.053 -1.029 . . . . 0.0 110.236 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 20.5 mm-40 -69.04 -41.32 77.81 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.969 -1.082 . . . . 0.0 110.201 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.871 HG23 HD11 ' A' ' 73' ' ' LEU . 4.5 tt -65.04 -30.05 49.21 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.416 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.223 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.858 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -65.4 -40.01 92.92 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 120.846 -1.159 . . . . 0.0 109.317 178.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -35.33 63.56 Favored 'General case' 0 N--CA 1.511 2.616 0 O-C-N 121.277 -0.89 . . . . 0.0 110.247 179.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.954 ' CE1' HG22 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -56.8 -47.29 80.55 Favored 'General case' 0 N--CA 1.513 2.709 0 O-C-N 121.037 -1.04 . . . . 0.0 109.922 179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.453 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 16.6 mt -63.63 -37.48 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.114 -0.991 . . . . 0.0 109.724 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.09 -39.56 95.08 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.144 -0.973 . . . . 0.0 109.664 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.13 -36.8 69.5 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.2 -0.937 . . . . 0.0 109.801 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.65 HD22 ' HD1' ' A' ' 57' ' ' PHE . 8.2 tp -79.76 -30.95 40.88 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.179 -0.951 . . . . 0.0 110.584 179.477 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 66.9 m -93.08 -38.14 11.78 Favored 'General case' 0 N--CA 1.503 2.221 0 O-C-N 120.835 -1.165 . . . . 0.0 110.349 179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -110.66 91.72 3.77 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.127 -0.983 . . . . 0.0 110.157 179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 15.3 ttmt -123.72 161.95 24.11 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.17 -0.956 . . . . 0.0 110.151 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.58 159.88 30.99 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.184 -0.947 . . . . 0.0 110.197 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.2 113.59 8.11 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.157 -0.965 . . . . 0.0 110.195 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 108.36 -74.41 0.21 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.586 -1.406 . . . . 0.0 109.586 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 16.7 p -119.89 153.37 54.86 Favored Pre-proline 0 N--CA 1.492 1.673 0 O-C-N 121.127 -1.219 . . . . 0.0 110.285 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.92 97.08 0.88 Allowed 'Trans proline' 0 C--N 1.317 -1.124 0 O-C-N 123.384 1.202 . . . . 0.0 110.443 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -125.95 145.31 50.34 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.177 -0.952 . . . . 0.0 110.249 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 21.1 mttt -122.37 134.57 54.62 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.27 -0.894 . . . . 0.0 110.253 -179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.1 tptm -119.0 134.46 55.18 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.16 -0.963 . . . . 0.0 110.189 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.74 164.88 14.33 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.232 -0.918 . . . . 0.0 110.267 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.4 t -121.8 117.0 51.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.222 -0.924 . . . . 0.0 109.983 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 9.2 p -138.04 142.88 34.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.246 -0.909 . . . . 0.0 110.213 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -130.6 107.73 9.4 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.287 -0.883 . . . . 0.0 110.202 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -123.07 140.71 52.75 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.233 -0.917 . . . . 0.0 110.289 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -121.0 104.62 9.94 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.256 -0.903 . . . . 0.0 110.214 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.4 mt -126.45 139.01 53.58 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.175 -0.953 . . . . 0.0 110.211 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.9 p -123.43 111.81 16.79 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.178 -0.951 . . . . 0.0 110.222 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 10.8 m . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 118.025 -0.988 . . . . 0.0 110.242 179.971 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.6 mtm . . . . . 0 N--CA 1.491 1.625 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.88 79.19 1.64 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.156 -0.965 . . . . 0.0 110.309 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -118.03 -57.56 2.08 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.162 -0.961 . . . . 0.0 110.099 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -115.82 126.14 53.6 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.274 -0.892 . . . . 0.0 110.154 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.1 mtp85 -123.64 125.95 45.72 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.191 -0.943 . . . . 0.0 110.414 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.693 ' HB3' HD22 ' A' ' 76' ' ' LEU . 0.7 OUTLIER -116.72 137.39 52.22 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.264 -0.898 . . . . 0.0 109.894 179.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.4 t -125.89 154.34 42.89 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.178 -0.951 . . . . 0.0 109.138 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.803 HG12 HG23 ' A' ' 32' ' ' ILE . 28.9 m -129.44 143.33 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.954 -1.091 . . . . 0.0 110.326 179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -158.22 138.15 12.24 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.185 -0.947 . . . . 0.0 110.986 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.461 ' OH ' ' HB2' ' A' ' 86' ' ' GLU . 1.7 m-85 -53.53 155.73 2.86 Favored 'General case' 0 N--CA 1.514 2.73 0 O-C-N 121.093 -1.004 . . . . 0.0 110.424 179.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.479 ' CB ' HG22 ' A' ' 25' ' ' ILE . . . -88.17 150.98 23.01 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 119.535 -0.866 . . . . 0.0 109.652 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 5.1 tttm -105.05 -163.64 0.97 Allowed 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.16 -0.963 . . . . 0.0 110.337 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -89.51 61.24 5.48 Favored 'General case' 0 N--CA 1.505 2.287 0 O-C-N 121.159 -0.963 . . . . 0.0 110.037 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.764 ' O ' HG22 ' A' ' 26' ' ' VAL . . . -130.27 -164.88 11.45 Favored Glycine 0 N--CA 1.492 2.433 0 N-CA-C 109.315 -1.514 . . . . 0.0 109.315 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.4 p -117.94 110.81 18.17 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.299 -1.118 . . . . 0.0 110.012 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -125.51 99.35 5.98 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.129 -0.982 . . . . 0.0 110.692 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -65.36 119.29 13.85 Favored Glycine 0 N--CA 1.488 2.143 0 N-CA-C 109.139 -1.584 . . . . 0.0 109.139 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 20.0 t -59.79 128.94 39.41 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.195 -1.18 . . . . 0.0 109.83 -179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.8 tptt -62.2 148.76 43.65 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.191 -0.943 . . . . 0.0 109.111 179.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt 52.71 45.05 29.45 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 120.991 -1.068 . . . . 0.0 109.647 -179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.4 t -164.74 153.45 12.6 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.35 -0.844 . . . . 0.0 110.742 -178.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -102.89 48.4 0.86 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.261 -0.899 . . . . 0.0 108.582 178.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -144.48 -174.65 4.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.467 -0.77 . . . . 0.0 110.286 -178.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 mttt -142.85 157.08 44.95 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.186 -0.946 . . . . 0.0 109.871 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.733 HG23 ' HB ' ' A' ' 29' ' ' VAL . 38.3 mt -110.56 113.51 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.392 -0.818 . . . . 0.0 109.579 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.764 HG22 ' O ' ' A' ' 14' ' ' GLY . 62.1 t -134.33 90.19 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 O-C-N 121.06 -1.025 . . . . 0.0 110.569 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 60.87 134.6 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.348 -0.845 . . . . 0.0 111.194 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.96 -24.12 33.6 Favored Glycine 0 N--CA 1.495 2.601 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.19 179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.733 ' HB ' HG23 ' A' ' 25' ' ' ILE . 57.9 t -114.38 136.95 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 CA-C-N 119.262 1.531 . . . . 0.0 110.373 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 44.0 t -77.27 139.5 39.84 Favored 'General case' 0 N--CA 1.505 2.308 0 C-N-CA 119.4 -0.92 . . . . 0.0 108.851 178.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HG2' HG21 ' A' ' 25' ' ' ILE . 44.0 mtm-85 -107.82 137.28 46.1 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.109 -0.995 . . . . 0.0 110.811 -179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.803 HG23 HG12 ' A' ' 8' ' ' VAL . 4.5 mt -109.01 125.13 66.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.6 122.28 7.46 Favored Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.656 -1.377 . . . . 0.0 109.656 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.448 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 3.6 ttpm? -104.45 113.07 26.39 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.414 -1.05 . . . . 0.0 109.469 179.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 50.0 t -97.45 107.21 19.68 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.132 0 O-C-N 121.174 -0.954 . . . . 0.0 110.04 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.434 HG23 ' HD2' ' A' ' 37' ' ' PRO . 9.7 p -124.66 143.27 42.99 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.434 ' HD2' HG23 ' A' ' 36' ' ' VAL . 47.8 Cg_endo -74.03 151.55 44.82 Favored 'Trans proline' 0 C--N 1.319 -1.009 0 O-C-N 123.209 1.11 . . . . 0.0 110.412 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -102.37 164.07 16.43 Favored Pre-proline 0 N--CA 1.5 2.034 0 O-C-N 121.303 -0.873 . . . . 0.0 110.102 179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.5 -40.0 3.28 Favored 'Trans proline' 0 C--N 1.316 -1.177 0 O-C-N 123.404 1.213 . . . . 0.0 110.496 -179.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -141.34 110.97 6.46 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.155 -0.966 . . . . 0.0 110.267 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.1 m -129.4 133.65 47.46 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.147 -0.971 . . . . 0.0 110.134 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -102.41 -47.25 4.54 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.266 -0.896 . . . . 0.0 110.65 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.0 p -88.49 -39.89 13.86 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.1 -1.0 . . . . 0.0 110.562 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -121.55 -163.57 12.0 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.87 -1.292 . . . . 0.0 109.87 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -140.79 -60.49 0.03 OUTLIER Glycine 0 N--CA 1.495 2.576 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -108.48 146.58 32.96 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.202 -1.175 . . . . 0.0 110.004 179.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 63.3 mtt -115.62 144.49 43.83 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.574 -179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -123.1 129.63 51.72 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.265 -0.897 . . . . 0.0 109.99 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -125.26 159.31 31.95 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.152 -0.968 . . . . 0.0 110.209 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.418 ' CE3' ' HB3' ' A' ' 31' ' ' ARG . 72.5 m95 -104.31 134.13 48.05 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.241 -0.912 . . . . 0.0 110.017 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -116.25 173.0 6.83 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.255 -0.903 . . . . 0.0 110.714 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.618 ' HD2' HG11 ' A' ' 29' ' ' VAL . 1.1 m170 -93.26 -171.79 2.76 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.986 HG22 ' CE1' ' A' ' 93' ' ' HIS . 49.3 mm -85.63 -45.0 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 C-N-CA 118.943 -1.103 . . . . 0.0 109.004 178.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.01 -21.66 29.37 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.042 -1.037 . . . . 0.0 111.341 179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 59.5 m -78.24 -41.69 33.5 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 120.753 -1.217 . . . . 0.0 109.759 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.35 -38.15 60.25 Favored 'General case' 0 N--CA 1.504 2.23 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.743 179.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.684 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 11.4 m-85 -71.76 -30.22 65.35 Favored 'General case' 0 N--CA 1.502 2.142 0 C-N-CA 118.987 -1.085 . . . . 0.0 109.677 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -61.16 -37.01 81.36 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 120.921 -1.112 . . . . 0.0 109.497 178.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.4 mmmt -58.87 -40.08 83.28 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.029 -1.044 . . . . 0.0 109.826 179.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.406 ' HB3' HD21 ' A' ' 97' ' ' LEU . 9.4 mp -58.96 -42.93 91.07 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.187 -0.946 . . . . 0.0 109.305 179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -57.74 -34.14 69.2 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.296 -0.878 . . . . 0.0 109.68 178.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -104.05 29.68 5.75 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.212 -0.93 . . . . 0.0 110.589 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -111.41 167.4 10.33 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.882 -1.136 . . . . 0.0 109.971 179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 37.8 mtt85 -71.07 157.21 38.59 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.164 -0.96 . . . . 0.0 110.095 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.32 -34.34 28.59 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.148 -0.97 . . . . 0.0 110.567 179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 13.2 p -51.53 -35.73 41.96 Favored 'General case' 0 N--CA 1.514 2.748 0 O-C-N 120.926 -1.109 . . . . 0.0 110.833 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 24.4 p -110.6 126.87 54.92 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.085 -1.009 . . . . 0.0 110.17 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.1 tmtt? -116.85 144.22 44.76 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.168 -0.957 . . . . 0.0 110.117 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -125.29 150.43 47.11 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.221 -0.924 . . . . 0.0 110.27 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.434 HG23 HD11 ' A' ' 76' ' ' LEU . 79.0 mt 53.6 96.82 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.153 0 O-C-N 121.162 -0.961 . . . . 0.0 110.76 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -115.69 133.06 56.41 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.135 -0.978 . . . . 0.0 109.936 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 51.49 -172.9 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.11 0 O-C-N 121.076 -1.015 . . . . 0.0 110.735 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.815 HD13 HG21 ' A' ' 90' ' ' ILE . 50.4 tp -117.19 84.33 2.13 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.134 -0.979 . . . . 0.0 110.397 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -171.91 -51.56 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 O-C-N 121.17 -0.956 . . . . 0.0 110.744 179.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -51.0 -30.87 16.34 Favored 'General case' 0 N--CA 1.512 2.666 0 O-C-N 121.113 -0.992 . . . . 0.0 111.23 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.693 HD22 ' HB3' ' A' ' 6' ' ' PHE . 30.8 mt -74.73 153.87 38.65 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.919 -1.113 . . . . 0.0 109.964 179.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -99.38 119.05 37.34 Favored 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.198 -0.939 . . . . 0.0 111.065 -178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.83 -38.81 1.46 Allowed Glycine 0 N--CA 1.495 2.567 0 N-CA-C 110.266 -1.133 . . . . 0.0 110.266 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.418 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 59.7 p-90 -51.39 -34.91 36.53 Favored 'General case' 0 N--CA 1.514 2.744 0 O-C-N 121.017 -1.284 . . . . 0.0 110.937 -179.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.418 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 6.4 tt0 -54.79 -35.9 64.33 Favored 'General case' 0 N--CA 1.513 2.685 0 O-C-N 120.982 -1.074 . . . . 0.0 110.565 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.6 mm-40 -80.54 -36.8 32.58 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.034 -1.041 . . . . 0.0 110.286 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.49 HD23 ' HG3' ' A' ' 86' ' ' GLU . 7.2 mp -48.9 172.74 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.131 -0.98 . . . . 0.0 111.206 -179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -105.11 163.2 12.74 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 121.212 -0.93 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -52.42 -39.42 60.97 Favored 'General case' 0 N--CA 1.512 2.651 0 O-C-N 121.179 -0.95 . . . . 0.0 110.798 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -61.97 -52.13 65.28 Favored 'General case' 0 N--CA 1.508 2.455 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.635 179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.49 ' HG3' HD23 ' A' ' 82' ' ' LEU . 14.0 tp10 -64.09 -40.97 97.38 Favored 'General case' 0 N--CA 1.507 2.417 0 C-N-CA 119.435 -0.906 . . . . 0.0 109.065 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.539 ' HG3' HD21 ' A' ' 73' ' ' LEU . 33.3 tttt -63.99 -39.39 94.0 Favored 'General case' 0 N--CA 1.506 2.355 0 C-N-CA 119.717 -0.793 . . . . 0.0 109.694 179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.33 -40.73 97.31 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 121.182 -0.949 . . . . 0.0 109.578 179.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -64.58 -37.81 88.85 Favored 'General case' 0 N--CA 1.507 2.415 0 C-N-CA 119.463 -0.895 . . . . 0.0 110.06 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.815 HG21 HD13 ' A' ' 73' ' ' LEU . 42.0 mm -64.86 -41.73 92.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.169 -0.957 . . . . 0.0 109.064 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 47.2 p -63.16 -47.08 84.19 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.119 -0.988 . . . . 0.0 109.426 179.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -64.25 -40.56 96.26 Favored 'General case' 0 N--CA 1.506 2.331 0 C-N-CA 119.401 -0.92 . . . . 0.0 108.981 178.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.986 ' CE1' HG22 ' A' ' 53' ' ' ILE . 64.6 t60 -61.15 -43.55 98.7 Favored 'General case' 0 N--CA 1.507 2.386 0 O-C-N 121.286 -0.884 . . . . 0.0 109.521 179.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.435 HG12 ' CE2' ' A' ' 57' ' ' PHE . 19.1 mt -70.44 -38.72 74.89 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.321 0 O-C-N 121.159 -0.963 . . . . 0.0 108.839 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.09 -39.09 91.29 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.137 -0.977 . . . . 0.0 109.375 178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.77 -37.0 80.38 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.165 -0.959 . . . . 0.0 109.829 179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.561 HD22 ' HD2' ' A' ' 57' ' ' PHE . 5.0 tp -88.07 -33.33 18.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.401 179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.3 m -102.17 54.51 0.8 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.945 -1.097 . . . . 0.0 110.206 179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 t -132.69 117.93 18.47 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.178 -0.951 . . . . 0.0 110.22 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.7 tptm -119.61 101.17 7.73 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.178 -0.951 . . . . 0.0 110.188 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -142.91 114.32 7.91 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.135 -0.978 . . . . 0.0 110.28 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -121.19 77.51 1.32 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.231 -0.918 . . . . 0.0 110.232 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -139.85 161.95 26.29 Favored Glycine 0 N--CA 1.493 2.491 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 m -118.48 94.24 46.96 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.14 -1.212 . . . . 0.0 110.153 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.3 -172.48 0.9 Allowed 'Trans proline' 0 C--N 1.317 -1.102 0 O-C-N 123.357 1.188 . . . . 0.0 110.482 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -116.13 -56.18 2.33 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.161 -0.962 . . . . 0.0 110.282 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.81 -166.09 1.06 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.115 -0.99 . . . . 0.0 110.148 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.6 mptp? -118.52 -64.6 1.27 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.216 -0.927 . . . . 0.0 110.131 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.59 136.6 53.17 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.233 -0.917 . . . . 0.0 110.222 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 61.5 t -130.06 142.61 43.35 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.816 0 O-C-N 121.271 -0.893 . . . . 0.0 109.898 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 62.0 t -117.62 138.59 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.161 -0.962 . . . . 0.0 109.956 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -127.31 149.1 50.19 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.293 -0.879 . . . . 0.0 110.299 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.36 138.46 51.78 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.244 -0.91 . . . . 0.0 110.193 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 46.2 mttt -122.68 129.79 52.23 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.225 -0.922 . . . . 0.0 110.17 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 13.6 tp -118.84 105.05 11.12 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.131 -0.981 . . . . 0.0 110.273 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.3 m -122.48 122.06 38.04 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.142 -0.973 . . . . 0.0 110.214 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.495 1.794 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.212 -179.932 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.5 ttm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.79 0.328 . . . . 0.0 110.157 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -129.44 77.14 1.77 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.14 -0.975 . . . . 0.0 110.233 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -133.47 92.64 3.02 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.173 -0.955 . . . . 0.0 110.106 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -118.23 150.8 38.83 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.179 -0.951 . . . . 0.0 110.281 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.6 mmt-85 -116.29 134.17 55.2 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.232 -0.917 . . . . 0.0 110.039 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.649 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.3 m-85 -116.99 144.99 43.94 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.169 -0.957 . . . . 0.0 110.277 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 51.0 t -131.56 153.09 50.22 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.351 -0.843 . . . . 0.0 108.952 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.523 HG12 HG23 ' A' ' 32' ' ' ILE . 24.2 m -126.95 132.0 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.058 0 O-C-N 120.994 -1.066 . . . . 0.0 110.568 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -147.68 159.63 43.57 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.087 -1.008 . . . . 0.0 110.561 -179.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.407 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -100.41 155.74 17.65 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.453 -0.78 . . . . 0.0 109.968 179.737 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.552 ' HB2' ' NE ' ' A' ' 31' ' ' ARG . . . -107.61 138.68 43.39 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.361 -0.837 . . . . 0.0 110.292 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 48.0 tttt -150.23 127.73 11.51 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.248 -0.907 . . . . 0.0 110.605 -179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.0 ttt85 54.71 99.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.093 -1.004 . . . . 0.0 110.844 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.869 ' O ' HG21 ' A' ' 26' ' ' VAL . . . 144.86 -151.41 23.55 Favored Glycine 0 N--CA 1.496 2.665 0 N-CA-C 109.814 -1.315 . . . . 0.0 109.814 179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.622 HG23 ' O ' ' A' ' 14' ' ' GLY . 0.9 OUTLIER -158.02 138.44 12.72 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.195 -1.179 . . . . 0.0 110.593 -179.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -143.98 107.16 4.53 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.157 -0.964 . . . . 0.0 110.539 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.67 114.72 7.13 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.451 ' CB ' HD11 ' A' ' 25' ' ' ILE . 24.6 t -61.06 128.49 36.71 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.207 -1.172 . . . . 0.0 109.521 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.426 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 19.1 tptt -61.8 148.09 44.27 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.196 -0.94 . . . . 0.0 109.091 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 49.3 mttt 52.74 45.62 28.35 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.946 -1.096 . . . . 0.0 109.669 -179.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 36.8 t -165.21 154.08 12.21 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.362 -0.836 . . . . 0.0 110.783 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -105.5 44.04 1.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 178.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -141.43 -177.11 4.99 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.491 -0.756 . . . . 0.0 110.015 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -126.71 161.68 27.57 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.019 -1.051 . . . . 0.0 110.264 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.93 HG23 ' CG1' ' A' ' 29' ' ' VAL . 7.1 mt -120.17 102.92 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.409 -0.807 . . . . 0.0 109.997 -179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.869 HG21 ' O ' ' A' ' 14' ' ' GLY . 9.5 p -162.32 143.93 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 121.24 -0.913 . . . . 0.0 111.266 -179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 5.9 tptp 52.84 99.75 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.261 -0.9 . . . . 0.0 111.558 179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 83.51 9.31 83.59 Favored Glycine 0 N--CA 1.496 2.652 0 C-N-CA 120.133 -1.032 . . . . 0.0 112.061 179.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.93 ' CG1' HG23 ' A' ' 25' ' ' ILE . 58.9 t -124.49 135.14 64.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 CA-C-N 119.891 1.846 . . . . 0.0 110.582 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.637 ' HB3' HD11 ' A' ' 53' ' ' ILE . 43.4 t -102.0 140.01 36.87 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 121.301 -0.875 . . . . 0.0 108.767 178.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.842 ' HB3' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -129.23 150.33 50.65 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.124 -0.985 . . . . 0.0 111.401 -179.172 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.523 HG23 HG12 ' A' ' 8' ' ' VAL . 19.2 mt -110.81 138.27 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.444 -0.785 . . . . 0.0 108.997 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.12 125.89 8.56 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.165 -1.574 . . . . 0.0 109.165 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.431 ' HG3' ' CE2' ' A' ' 6' ' ' PHE . 22.0 ttmt -107.51 120.54 42.47 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.238 -1.154 . . . . 0.0 109.804 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 59.5 t -101.63 107.5 21.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.058 -1.026 . . . . 0.0 110.28 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.444 HG23 ' HD2' ' A' ' 37' ' ' PRO . 8.4 p -124.66 143.5 43.66 Favored Pre-proline 0 N--CA 1.495 1.817 0 O-C-N 121.252 -0.905 . . . . 0.0 110.098 179.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.444 ' HD2' HG23 ' A' ' 36' ' ' VAL . 46.6 Cg_endo -72.96 126.36 11.2 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 O-C-N 123.089 1.047 . . . . 0.0 110.228 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -105.1 117.79 57.66 Favored Pre-proline 0 N--CA 1.5 2.03 0 O-C-N 121.165 -0.959 . . . . 0.0 110.231 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -74.84 70.0 5.27 Favored 'Trans proline' 0 N--CA 1.485 0.998 0 O-C-N 123.193 1.102 . . . . 0.0 110.313 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -148.17 -58.93 0.24 Allowed 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.113 -0.992 . . . . 0.0 110.449 -179.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 21.8 p -108.68 157.39 18.57 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.228 -0.92 . . . . 0.0 110.178 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -95.97 -39.62 9.68 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.228 -0.92 . . . . 0.0 110.41 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.9 t -58.28 -40.14 81.13 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.047 -1.033 . . . . 0.0 110.109 179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -108.77 75.34 0.21 Allowed Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.371 -1.491 . . . . 0.0 109.371 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.76 -45.43 96.25 Favored Glycine 0 N--CA 1.493 2.466 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -115.78 138.85 50.73 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.259 -1.142 . . . . 0.0 110.257 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 12.6 ttt -117.25 143.62 45.7 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.221 -0.924 . . . . 0.0 110.385 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -117.99 128.51 54.85 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.249 -0.907 . . . . 0.0 110.139 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -122.95 148.59 45.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.21 -0.931 . . . . 0.0 109.777 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 23.4 m95 -94.23 163.25 13.52 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.137 -0.977 . . . . 0.0 109.94 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.426 ' CE1' ' HB3' ' A' ' 19' ' ' LYS . 89.0 m-85 -146.29 174.82 11.01 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.307 -0.871 . . . . 0.0 110.459 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CD2' HG12 ' A' ' 25' ' ' ILE . 1.8 m80 -99.44 -175.79 3.1 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.331 -0.855 . . . . 0.0 108.831 178.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.929 HG22 ' CE1' ' A' ' 93' ' ' HIS . 49.8 mm -83.98 -34.34 10.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.209 0 O-C-N 121.076 -1.015 . . . . 0.0 109.582 178.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -91.38 -32.45 15.65 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 120.695 -1.253 . . . . 0.0 110.594 178.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.402 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 70.9 m -63.46 -52.38 61.65 Favored 'General case' 0 N--CA 1.51 2.552 0 O-C-N 120.959 -1.088 . . . . 0.0 110.744 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.411 ' HB2' ' HB3' ' A' ' 51' ' ' TYR . 11.7 tpt -67.76 -38.27 83.23 Favored 'General case' 0 N--CA 1.507 2.418 0 C-N-CA 119.442 -0.903 . . . . 0.0 110.42 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 13.2 m-85 -76.77 -27.0 55.13 Favored 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.015 179.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -75.21 -37.12 61.27 Favored 'General case' 0 N--CA 1.506 2.341 0 O-C-N 120.836 -1.165 . . . . 0.0 109.407 178.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 -40.85 82.32 Favored 'General case' 0 N--CA 1.507 2.388 0 C-N-CA 119.24 -0.984 . . . . 0.0 109.31 179.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.854 HD23 HD21 ' A' ' 97' ' ' LEU . 3.8 tp -62.5 -40.54 97.03 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 121.405 -0.809 . . . . 0.0 109.606 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 16.4 tt0 -70.31 -33.32 71.38 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.181 -0.949 . . . . 0.0 110.424 179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.86 -30.62 21.31 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.11 -0.994 . . . . 0.0 111.059 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -107.88 99.82 9.24 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.877 -1.139 . . . . 0.0 110.434 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 4.9 ttp85 -121.34 104.45 9.71 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.288 -0.883 . . . . 0.0 109.802 179.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.691 ' O ' HG23 ' A' ' 66' ' ' THR . . . -87.3 -37.23 17.35 Favored 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.166 -0.959 . . . . 0.0 110.685 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.691 HG23 ' O ' ' A' ' 65' ' ' ALA . 0.0 OUTLIER -172.38 -51.91 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.145 -0.972 . . . . 0.0 111.035 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.43 160.81 17.38 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.157 -0.964 . . . . 0.0 110.475 -179.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 37.2 mttt -99.34 146.87 25.8 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 121.26 -0.9 . . . . 0.0 110.019 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -101.15 160.1 14.68 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.2 -0.937 . . . . 0.0 110.305 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.7 mt 55.69 99.79 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.179 -0.951 . . . . 0.0 110.538 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -113.55 143.62 44.24 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.205 -0.934 . . . . 0.0 110.001 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.26 -172.33 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.093 -1.005 . . . . 0.0 110.423 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.958 HD22 HG23 ' A' ' 91' ' ' THR . 13.2 tp -122.54 37.38 4.41 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.218 -0.926 . . . . 0.0 110.71 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -144.42 36.56 1.21 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.085 -1.01 . . . . 0.0 110.404 179.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -134.98 33.53 3.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.245 -0.909 . . . . 0.0 110.101 179.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.649 HD22 ' HB3' ' A' ' 6' ' ' PHE . 55.2 mt -138.91 156.36 47.34 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.093 -1.004 . . . . 0.0 109.729 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -86.55 104.66 16.2 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.167 -0.958 . . . . 0.0 110.875 -179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 140.97 -30.12 2.28 Favored Glycine 0 N--CA 1.495 2.604 0 C-N-CA 119.519 -1.324 . . . . 0.0 111.806 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.424 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 19.0 p-90 -57.65 -34.23 69.13 Favored 'General case' 0 N--CA 1.512 2.664 0 CA-C-N 119.492 1.646 . . . . 0.0 110.761 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.424 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 23.5 tt0 -55.78 -35.61 66.46 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 120.943 -1.098 . . . . 0.0 110.487 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.1 mt-10 -74.49 -32.77 62.65 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 121.03 -1.044 . . . . 0.0 110.811 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -49.8 174.44 0.02 OUTLIER 'General case' 0 N--CA 1.519 2.979 0 O-C-N 120.971 -1.081 . . . . 0.0 110.913 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.9 mt-10 -105.43 161.77 14.03 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.175 -0.953 . . . . 0.0 110.452 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -58.54 -50.12 74.91 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.226 -0.921 . . . . 0.0 110.347 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -61.18 -37.2 82.06 Favored 'General case' 0 N--CA 1.508 2.439 0 O-C-N 121.238 -0.914 . . . . 0.0 110.203 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 55.4 mt-10 -73.27 -41.22 63.88 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.132 -0.98 . . . . 0.0 108.805 178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.478 ' O ' HG22 ' A' ' 90' ' ' ILE . 34.7 tttt -58.89 -34.86 72.13 Favored 'General case' 0 N--CA 1.507 2.382 0 O-C-N 121.372 -0.83 . . . . 0.0 109.949 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -65.13 -35.6 81.62 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 121.091 -1.006 . . . . 0.0 109.987 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.8 tp60 -67.51 -47.31 70.33 Favored 'General case' 0 N--CA 1.508 2.437 0 O-C-N 120.981 -1.074 . . . . 0.0 110.083 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.478 HG22 ' O ' ' A' ' 87' ' ' LYS . 18.2 tt -63.98 -34.43 68.4 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.437 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.823 179.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.958 HG23 HD22 ' A' ' 73' ' ' LEU . 0.8 OUTLIER -63.35 -39.38 94.39 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 120.912 -1.117 . . . . 0.0 109.179 178.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -55.77 -38.63 70.14 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.141 -0.974 . . . . 0.0 109.969 179.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.929 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.4 m-70 -60.69 -53.33 58.69 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.196 -0.94 . . . . 0.0 109.837 179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.449 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 13.6 mt -61.94 -38.73 81.39 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.33 -0.948 . . . . 0.0 109.484 179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.19 -40.24 93.18 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.156 -0.965 . . . . 0.0 109.508 179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -68.53 -43.4 76.82 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.234 -0.916 . . . . 0.0 108.797 178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.854 HD21 HD23 ' A' ' 60' ' ' LEU . 13.6 tp -60.56 -34.97 74.94 Favored 'General case' 0 N--CA 1.507 2.416 0 O-C-N 121.282 -0.886 . . . . 0.0 109.962 179.012 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 36.7 m -98.14 50.91 1.02 Allowed 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.088 -1.007 . . . . 0.0 110.116 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.428 ' OG ' ' N ' ' A' ' 100' ' ' LYS . 9.5 t -118.55 -171.76 2.15 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.125 -0.985 . . . . 0.0 110.056 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.428 ' N ' ' OG ' ' A' ' 99' ' ' SER . 10.2 mttp -134.41 40.37 3.0 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.162 -0.961 . . . . 0.0 110.211 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -143.34 130.15 20.42 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.286 -0.884 . . . . 0.0 110.204 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.53 42.91 1.62 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.193 -0.942 . . . . 0.0 110.346 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 105.42 -71.83 0.23 Allowed Glycine 0 N--CA 1.493 2.464 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 18.7 p -117.68 157.74 47.15 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.282 -1.128 . . . . 0.0 110.28 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.54 122.2 8.07 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.394 1.207 . . . . 0.0 110.361 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.8 mttp -120.57 41.16 3.32 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.237 -0.914 . . . . 0.0 110.154 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 17.7 tttp 52.68 71.66 0.46 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.06 -1.025 . . . . 0.0 110.751 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm -119.76 81.64 1.76 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.126 -0.984 . . . . 0.0 110.218 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -127.84 111.0 13.14 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.206 -0.934 . . . . 0.0 110.222 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.5 t -115.3 100.42 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.189 -0.945 . . . . 0.0 109.918 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.3 t -126.14 143.43 39.69 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.193 -0.942 . . . . 0.0 109.957 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.5 mm100 -114.57 87.94 2.75 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.273 -0.892 . . . . 0.0 110.166 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -125.47 140.44 52.77 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.222 -0.924 . . . . 0.0 110.243 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 18.8 ttpt -117.09 107.1 14.09 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.192 -0.943 . . . . 0.0 110.224 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.5 tt -125.88 108.76 11.76 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.272 -0.892 . . . . 0.0 110.179 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.7 m -121.53 147.43 45.81 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.202 -0.936 . . . . 0.0 110.228 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.2 p . . . . . 0 N--CA 1.494 1.725 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.233 179.945 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 ttt . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.98 130.91 53.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.282 -0.886 . . . . 0.0 110.282 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.2 mm-40 -127.96 -66.02 0.88 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.165 -0.959 . . . . 0.0 110.253 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -152.04 134.66 15.41 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.176 -0.952 . . . . 0.0 110.606 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -125.08 143.99 50.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.208 -0.933 . . . . 0.0 110.165 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.539 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.7 m-85 -118.78 149.57 41.27 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.289 -0.882 . . . . 0.0 110.209 -179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.437 ' O ' HG23 ' A' ' 32' ' ' ILE . 10.4 m -135.41 164.81 26.92 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.254 -0.904 . . . . 0.0 109.421 179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.466 ' HB ' HD23 ' A' ' 76' ' ' LEU . 3.9 p -139.29 112.87 6.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.053 -1.03 . . . . 0.0 110.231 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -125.77 142.97 51.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.244 -0.91 . . . . 0.0 109.699 179.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.454 ' CD1' ' HB3' ' A' ' 82' ' ' LEU . 95.9 m-85 -99.6 137.75 37.65 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.229 -0.919 . . . . 0.0 109.667 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -54.58 134.66 46.72 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.043 -1.036 . . . . 0.0 110.742 -179.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 32.4 tttt -119.63 -58.02 1.93 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.239 -0.913 . . . . 0.0 110.014 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 14.2 mtm-85 -147.82 38.61 0.92 Allowed 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.219 -0.925 . . . . 0.0 110.513 179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -146.92 157.56 27.45 Favored Glycine 0 N--CA 1.496 2.641 0 N-CA-C 109.858 -1.297 . . . . 0.0 109.858 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.471 HG22 ' HA ' ' A' ' 26' ' ' VAL . 75.4 p -140.53 140.73 35.28 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.21 -1.171 . . . . 0.0 110.205 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -161.0 151.12 17.56 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.206 -0.934 . . . . 0.0 111.398 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -54.46 127.02 38.74 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 108.822 -1.711 . . . . 0.0 108.822 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.48 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 23.4 p -64.53 127.9 33.49 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.272 -1.134 . . . . 0.0 110.826 -178.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.44 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 1.2 mptm? -75.82 156.51 34.39 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 121.52 -0.738 . . . . 0.0 109.308 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.3 tptp 65.89 16.25 10.4 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 120.904 -1.122 . . . . 0.0 111.529 -178.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.3 p -174.83 149.14 1.14 Allowed 'General case' 0 N--CA 1.502 2.158 0 O-C-N 120.572 -1.33 . . . . 0.0 110.646 178.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 47.5 tttt -85.07 88.84 7.5 Favored 'General case' 0 N--CA 1.514 2.727 0 O-C-N 120.986 -1.071 . . . . 0.0 111.776 -177.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.422 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.0 tt0 -166.97 -174.56 2.73 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.277 -0.889 . . . . 0.0 110.408 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.09 152.73 47.63 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.039 -1.038 . . . . 0.0 109.656 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.502 HD13 ' HD3' ' A' ' 31' ' ' ARG . 80.9 mt -105.25 118.82 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.344 -0.847 . . . . 0.0 110.024 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.474 ' O ' HG12 ' A' ' 29' ' ' VAL . 57.2 t -115.65 159.0 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.228 -0.92 . . . . 0.0 109.96 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 24.9 tttt -49.99 132.94 23.1 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.28 -0.888 . . . . 0.0 110.752 -179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.37 9.7 40.76 Favored Glycine 0 N--CA 1.494 2.531 0 C-N-CA 120.083 -1.056 . . . . 0.0 111.591 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.8 p -123.65 135.13 64.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 CA-C-N 119.682 1.741 . . . . 0.0 110.536 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.431 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 23.8 p -87.01 141.59 28.56 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.229 -0.92 . . . . 0.0 110.239 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.502 ' HD3' HD13 ' A' ' 25' ' ' ILE . 2.2 ptt180 -138.85 144.52 39.26 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.192 -0.943 . . . . 0.0 110.349 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.437 HG23 ' O ' ' A' ' 7' ' ' CYS . 12.2 mt -106.51 126.9 62.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 O-C-N 121.222 -0.924 . . . . 0.0 109.277 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.0 133.74 11.54 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.251 -1.539 . . . . 0.0 109.251 179.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.467 ' HE2' HG21 ' A' ' 36' ' ' VAL . 33.0 tttt -103.77 121.83 43.83 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.159 -1.201 . . . . 0.0 109.298 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 54.0 t -91.97 112.6 25.94 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.175 0 O-C-N 121.154 -0.966 . . . . 0.0 110.411 -179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.467 HG21 ' HE2' ' A' ' 34' ' ' LYS . 65.3 t -120.37 141.4 31.86 Favored Pre-proline 0 N--CA 1.493 1.712 0 O-C-N 121.141 -0.975 . . . . 0.0 109.727 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -74.63 129.64 12.89 Favored 'Trans proline' 0 C--N 1.317 -1.081 0 O-C-N 123.259 1.137 . . . . 0.0 110.431 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -103.55 156.96 34.81 Favored Pre-proline 0 N--CA 1.499 1.991 0 O-C-N 121.149 -0.969 . . . . 0.0 110.107 179.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.95 110.63 3.08 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 O-C-N 123.432 1.227 . . . . 0.0 110.407 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER 54.35 98.78 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.0 -1.062 . . . . 0.0 110.774 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.0 m -111.84 156.36 22.13 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.195 -0.941 . . . . 0.0 110.203 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -101.84 -45.4 5.23 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.288 -0.883 . . . . 0.0 110.759 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.0 t -88.15 -44.15 11.11 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.052 -1.03 . . . . 0.0 110.454 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -147.74 135.42 5.57 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 110.087 -1.205 . . . . 0.0 110.087 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.74 -38.98 96.06 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 109.83 -1.308 . . . . 0.0 109.83 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 57.0 m-20 -107.6 146.96 31.25 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.228 -1.16 . . . . 0.0 110.068 179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 18.4 ttm -117.08 151.51 36.66 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.187 -0.946 . . . . 0.0 110.608 -179.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.431 ' HD2' ' CZ2' ' A' ' 50' ' ' TRP . 7.8 pttt -131.71 142.7 49.87 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.341 -0.849 . . . . 0.0 109.905 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -120.8 134.23 55.3 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.102 -0.999 . . . . 0.0 109.911 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.431 ' CZ2' ' HD2' ' A' ' 48' ' ' LYS . 17.0 m95 -91.56 114.47 27.01 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.074 -1.016 . . . . 0.0 110.591 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.539 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 0.8 OUTLIER -125.44 171.0 10.83 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.611 177.803 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.48 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 71.0 m80 -87.74 -173.5 4.34 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.49 -0.756 . . . . 0.0 110.028 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.554 HG22 ' ND1' ' A' ' 93' ' ' HIS . 30.8 mm -84.61 -52.75 12.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 178.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 30.9 ttpt -60.22 -37.85 81.57 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.222 -0.924 . . . . 0.0 109.259 178.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -61.49 -51.29 69.26 Favored 'General case' 0 N--CA 1.506 2.37 0 O-C-N 121.25 -0.906 . . . . 0.0 109.083 179.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.42 ' HB2' ' CD1' ' A' ' 51' ' ' TYR . 9.0 tpt -68.94 -44.41 73.1 Favored 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.339 -0.851 . . . . 0.0 109.302 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.442 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 10.6 m-85 -64.12 -29.72 70.83 Favored 'General case' 0 N--CA 1.501 2.122 0 C-N-CA 119.157 -1.017 . . . . 0.0 109.721 178.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -59.48 -40.09 85.86 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 120.989 -1.069 . . . . 0.0 109.391 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -66.22 -40.17 90.1 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.236 -0.915 . . . . 0.0 109.114 178.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.6 mp -57.8 -42.18 83.65 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.255 -0.903 . . . . 0.0 109.205 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -58.84 -35.65 73.25 Favored 'General case' 0 N--CA 1.507 2.417 0 O-C-N 121.221 -0.924 . . . . 0.0 109.53 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 37.3 mtt180 -105.23 30.56 5.53 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.228 -0.92 . . . . 0.0 110.457 179.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -116.96 168.84 9.88 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.022 -1.049 . . . . 0.0 110.072 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.5 ttt85 -62.64 152.95 33.79 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.169 -0.957 . . . . 0.0 109.999 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.42 -34.67 20.08 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.183 -0.948 . . . . 0.0 110.628 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.45 -36.1 42.58 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.988 -1.07 . . . . 0.0 110.876 -179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.4 m -111.2 114.04 26.97 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.079 -1.013 . . . . 0.0 110.181 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.97 144.98 43.94 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.181 -0.949 . . . . 0.0 110.181 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.07 153.92 28.61 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.188 -0.945 . . . . 0.0 110.263 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.7 mt 54.49 100.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.079 0 O-C-N 121.197 -0.939 . . . . 0.0 110.804 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -107.02 134.09 50.69 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.126 -0.984 . . . . 0.0 109.577 179.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 53.83 -163.65 0.1 Allowed 'General case' 0 N--CA 1.501 2.121 0 O-C-N 120.996 -1.065 . . . . 0.0 110.188 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.71 HD21 ' HG2' ' A' ' 87' ' ' LYS . 58.1 tp -103.87 73.87 1.19 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.984 -1.073 . . . . 0.0 109.811 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -167.85 -160.0 0.32 Allowed 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.182 -0.949 . . . . 0.0 110.406 -179.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.609 ' O ' HD12 ' A' ' 76' ' ' LEU . 4.8 mm-40 54.6 38.89 30.7 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.911 -1.118 . . . . 0.0 110.238 -179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.609 HD12 ' O ' ' A' ' 75' ' ' GLU . 1.1 tp -141.85 150.92 42.22 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.304 -0.873 . . . . 0.0 109.412 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -100.89 104.47 15.68 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.137 -0.977 . . . . 0.0 110.829 -179.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.739 ' CA ' HD12 ' A' ' 82' ' ' LEU . . . 140.78 -37.97 1.61 Allowed Glycine 0 N--CA 1.493 2.483 0 C-N-CA 120.012 -1.089 . . . . 0.0 110.51 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -62.15 -28.18 69.47 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.931 -1.335 . . . . 0.0 111.022 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -51.42 -32.27 25.87 Favored 'General case' 0 N--CA 1.51 2.53 0 O-C-N 120.853 -1.154 . . . . 0.0 111.87 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -165.1 50.94 0.11 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 118.811 -1.156 . . . . 0.0 112.62 -179.372 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.739 HD12 ' CA ' ' A' ' 78' ' ' GLY . 18.0 mt -118.31 -67.73 0.97 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.842 -1.162 . . . . 0.0 109.604 178.368 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.446 ' HB3' ' CE2' ' A' ' 10' ' ' TYR . 5.1 tp10 -121.0 127.81 52.12 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.143 -0.973 . . . . 0.0 109.815 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.4 -50.33 6.18 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.079 -1.013 . . . . 0.0 110.764 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -62.49 -46.43 88.49 Favored 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.193 -0.942 . . . . 0.0 109.628 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -62.76 -36.92 84.63 Favored 'General case' 0 N--CA 1.505 2.29 0 C-N-CA 119.438 -0.905 . . . . 0.0 109.722 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.885 ' HA ' HD12 ' A' ' 90' ' ' ILE . 19.6 ttpt -60.39 -39.76 88.49 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.141 -0.974 . . . . 0.0 109.793 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -61.61 -41.73 97.87 Favored 'General case' 0 N--CA 1.507 2.396 0 O-C-N 121.18 -0.95 . . . . 0.0 109.558 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -61.01 -36.2 78.87 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.234 -0.916 . . . . 0.0 110.181 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.885 HD12 ' HA ' ' A' ' 87' ' ' LYS . 44.9 mt -60.11 -38.04 75.39 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.081 -1.012 . . . . 0.0 109.775 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -39.91 86.11 Favored 'General case' 0 N--CA 1.509 2.522 0 O-C-N 120.905 -1.122 . . . . 0.0 109.771 179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -59.66 -38.38 81.29 Favored 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.236 -0.915 . . . . 0.0 109.737 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.554 ' ND1' HG22 ' A' ' 53' ' ' ILE . 20.7 m-70 -56.46 -47.18 79.71 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.157 -0.964 . . . . 0.0 110.137 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.481 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.9 mp -64.88 -39.75 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 C-N-CA 119.346 -0.942 . . . . 0.0 109.182 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.38 -40.43 81.39 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.16 -0.962 . . . . 0.0 109.383 179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -64.25 -40.17 95.46 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.251 -0.906 . . . . 0.0 109.515 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 97' ' ' LEU . 9.2 tp -71.09 -33.38 70.12 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.247 -0.908 . . . . 0.0 110.233 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 40.3 t -102.76 40.06 1.43 Allowed 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.047 -1.033 . . . . 0.0 110.171 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 7.6 t -164.91 132.33 3.1 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.177 -0.952 . . . . 0.0 110.842 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.7 mmmt -123.06 -65.38 1.1 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.183 -0.948 . . . . 0.0 110.247 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -143.38 -165.3 2.05 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.243 -0.911 . . . . 0.0 110.253 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -115.43 175.49 5.5 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.144 -0.972 . . . . 0.0 110.138 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -65.18 108.76 2.5 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.57 -1.412 . . . . 0.0 109.57 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -142.12 146.22 39.09 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 121.231 -1.158 . . . . 0.0 110.171 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.47 88.57 1.0 Allowed 'Trans proline' 0 C--N 1.319 -1.025 0 O-C-N 123.341 1.18 . . . . 0.0 110.402 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 22.4 tttp -143.53 142.4 31.11 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.247 -0.908 . . . . 0.0 110.27 -179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 3.5 mptt -122.76 147.4 46.55 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.267 -0.896 . . . . 0.0 110.143 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -131.24 -60.64 0.95 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.157 -0.964 . . . . 0.0 110.207 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -135.23 144.71 47.04 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.211 -0.93 . . . . 0.0 110.155 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 27.5 m -131.17 141.14 46.79 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.205 -0.935 . . . . 0.0 110.471 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.7 t -139.81 133.03 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.147 -0.97 . . . . 0.0 110.007 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -133.01 147.24 52.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.167 -0.958 . . . . 0.0 110.32 179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -120.83 141.28 50.71 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.175 -0.953 . . . . 0.0 110.096 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 31.1 tttt -116.64 131.49 56.94 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.178 -0.951 . . . . 0.0 110.295 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.3 tt -120.16 112.79 19.53 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.203 -0.935 . . . . 0.0 110.247 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 21.3 m -117.77 105.45 11.98 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.202 -0.936 . . . . 0.0 110.22 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.7 p . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 118.029 -0.986 . . . . 0.0 110.205 179.995 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -137.04 161.7 35.35 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.243 -0.91 . . . . 0.0 110.203 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -140.45 -65.33 0.45 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.294 -0.879 . . . . 0.0 110.259 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 -118.0 162.16 18.62 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.197 -0.94 . . . . 0.0 110.261 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.0 mtt180 -130.43 148.41 52.24 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.163 -0.961 . . . . 0.0 110.295 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.758 ' HB3' HD22 ' A' ' 76' ' ' LEU . 2.8 m-85 -114.09 153.48 29.4 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.316 -0.865 . . . . 0.0 110.25 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.3 t -135.69 124.68 24.24 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.438 -0.789 . . . . 0.0 109.318 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.822 HG12 HG23 ' A' ' 32' ' ' ILE . 20.5 m -101.16 134.57 40.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 O-C-N 121.222 -0.924 . . . . 0.0 110.736 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -143.89 108.4 4.85 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.558 ' CD2' HD13 ' A' ' 82' ' ' LEU . 11.6 m-85 -56.08 158.85 3.68 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.105 -0.997 . . . . 0.0 110.304 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.32 119.01 32.46 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.363 -0.836 . . . . 0.0 110.007 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 31.7 mttt -111.14 -53.11 2.74 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.165 -0.96 . . . . 0.0 110.39 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.2 mtt180 -139.93 96.5 3.07 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.184 -0.947 . . . . 0.0 110.191 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 143.45 122.33 1.66 Allowed Glycine 0 N--CA 1.494 2.529 0 N-CA-C 109.783 -1.327 . . . . 0.0 109.783 179.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.65 HG22 ' HA ' ' A' ' 26' ' ' VAL . 75.8 p -115.78 144.2 44.32 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.198 -1.178 . . . . 0.0 109.875 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -154.86 151.49 28.66 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.219 -0.926 . . . . 0.0 111.228 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.98 125.19 32.45 Favored Glycine 0 N--CA 1.497 2.761 0 N-CA-C 108.696 -1.761 . . . . 0.0 108.696 179.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.485 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 23.8 p -63.85 126.96 29.3 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.198 -1.178 . . . . 0.0 110.892 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.437 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 37.8 mmtt -74.89 156.27 36.57 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.601 -0.687 . . . . 0.0 109.178 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.46 15.54 10.14 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.938 -1.101 . . . . 0.0 111.601 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.409 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 8.6 p -174.88 150.39 1.25 Allowed 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.515 -1.366 . . . . 0.0 110.767 178.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.1 89.64 7.88 Favored 'General case' 0 N--CA 1.515 2.776 0 O-C-N 121.043 -1.036 . . . . 0.0 111.668 -178.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.417 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.0 tt0 -167.02 -173.95 2.51 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.312 -0.867 . . . . 0.0 110.289 178.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.6 pttt -130.05 149.19 51.87 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.074 -1.016 . . . . 0.0 109.819 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.661 HG23 ' CG1' ' A' ' 29' ' ' VAL . 81.2 mt -101.24 120.74 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.06 0 O-C-N 121.194 -0.941 . . . . 0.0 109.711 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.65 ' HA ' HG22 ' A' ' 15' ' ' THR . 59.8 t -108.57 157.02 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 0 O-C-N 121.233 -0.917 . . . . 0.0 110.061 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.3 mtpp -51.39 126.73 17.89 Favored 'General case' 0 N--CA 1.514 2.747 0 O-C-N 121.273 -0.892 . . . . 0.0 110.704 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 104.3 9.67 35.71 Favored Glycine 0 N--CA 1.496 2.649 0 C-N-CA 120.044 -1.074 . . . . 0.0 111.843 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.661 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.6 p -113.78 135.03 54.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 CA-C-N 119.783 1.792 . . . . 0.0 110.436 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.448 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.3 p -78.36 133.77 37.53 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.193 -0.942 . . . . 0.0 109.903 179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 12.3 ptt-85 -132.24 140.33 48.62 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.157 -0.964 . . . . 0.0 110.18 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.822 HG23 HG12 ' A' ' 8' ' ' VAL . 9.9 mt -107.83 125.24 64.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.26 -0.9 . . . . 0.0 109.447 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.57 144.86 15.89 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.568 -1.413 . . . . 0.0 109.568 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.439 ' HB3' ' CE2' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -119.43 135.21 54.85 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.118 -1.225 . . . . 0.0 109.453 179.336 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.7 t -111.98 111.78 37.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.943 -1.098 . . . . 0.0 110.241 -179.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 74.5 t -116.45 112.41 41.36 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 121.242 -0.912 . . . . 0.0 109.758 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.94 126.08 10.96 Favored 'Trans proline' 0 N--CA 1.486 1.071 0 O-C-N 123.232 1.122 . . . . 0.0 110.503 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -105.37 118.57 55.4 Favored Pre-proline 0 N--CA 1.498 1.969 0 O-C-N 121.187 -0.946 . . . . 0.0 110.01 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.05 71.76 2.8 Favored 'Trans proline' 0 N--CA 1.485 1.024 0 O-C-N 123.147 1.077 . . . . 0.0 110.342 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -145.18 -59.12 0.35 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.092 -1.005 . . . . 0.0 110.331 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 29.4 t -108.35 156.98 18.79 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.153 -0.967 . . . . 0.0 110.181 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -97.58 -41.28 8.22 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.159 -0.963 . . . . 0.0 110.468 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 53.4 m -55.93 -39.32 71.5 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.003 -1.061 . . . . 0.0 110.333 -179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -78.16 -72.12 1.18 Allowed Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 82.95 -77.31 2.14 Favored Glycine 0 N--CA 1.493 2.476 0 N-CA-C 109.605 -1.398 . . . . 0.0 109.605 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -132.45 143.62 49.91 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.183 -1.187 . . . . 0.0 110.264 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.7 mmm -117.84 135.43 54.09 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.222 -0.923 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.419 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -116.77 143.87 45.14 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.258 -0.901 . . . . 0.0 109.713 179.563 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -132.09 137.75 47.86 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.088 -1.007 . . . . 0.0 110.459 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.419 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 25.8 m95 -94.05 117.19 29.76 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.087 -1.008 . . . . 0.0 110.82 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.523 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.92 172.38 10.49 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.032 -1.042 . . . . 0.0 109.689 177.679 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.485 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.1 m80 -88.96 -173.11 3.95 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.335 -0.853 . . . . 0.0 110.238 -179.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.531 HG22 ' ND1' ' A' ' 93' ' ' HIS . 23.0 mm -86.13 -50.77 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.7 tttt -61.87 -38.47 88.39 Favored 'General case' 0 N--CA 1.506 2.354 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.097 178.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.1 m -61.78 -50.94 70.32 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.172 -0.955 . . . . 0.0 108.98 178.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.431 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -67.28 -45.42 76.67 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.465 -0.772 . . . . 0.0 109.655 179.796 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -66.67 -28.65 68.63 Favored 'General case' 0 N--CA 1.502 2.156 0 C-N-CA 119.214 -0.995 . . . . 0.0 110.023 179.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -69.09 -42.43 76.18 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 120.896 -1.128 . . . . 0.0 108.894 178.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mtpt -74.97 -42.32 57.83 Favored 'General case' 0 N--CA 1.503 2.209 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.8 tp -62.39 -38.89 91.38 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.407 -0.808 . . . . 0.0 109.143 178.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.2 tt0 -67.03 -32.73 74.14 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.183 -0.948 . . . . 0.0 110.131 179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 28.6 mtp180 -102.42 16.37 26.47 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.046 -1.034 . . . . 0.0 111.699 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -136.36 97.96 3.72 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.668 -1.27 . . . . 0.0 110.131 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -123.17 102.09 7.76 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.203 -0.935 . . . . 0.0 110.276 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' A' ' 66' ' ' THR . . . -90.07 -38.81 13.31 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.205 -0.934 . . . . 0.0 110.22 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 65' ' ' ALA . 18.5 m -165.14 -55.3 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.193 -0.942 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 10.1 t -116.55 162.43 17.61 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.289 -0.882 . . . . 0.0 110.398 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 13.3 tttt -96.34 146.18 24.96 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.226 -0.921 . . . . 0.0 110.079 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -100.03 160.55 14.23 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.215 -0.928 . . . . 0.0 110.177 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.1 mt 55.28 99.22 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.147 -0.971 . . . . 0.0 110.613 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -110.2 134.6 52.06 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.264 -0.898 . . . . 0.0 109.685 179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.47 -164.75 0.09 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.059 -1.026 . . . . 0.0 110.206 -179.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.536 HD22 ' OG1' ' A' ' 91' ' ' THR . 25.9 tp -121.7 53.84 1.17 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.08 -1.012 . . . . 0.0 110.765 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -153.42 37.03 0.47 Allowed 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.175 -0.953 . . . . 0.0 110.755 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.47 ' O ' HD23 ' A' ' 76' ' ' LEU . 1.4 tm-20 -133.63 30.27 3.8 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.1 -1.0 . . . . 0.0 110.533 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.758 HD22 ' HB3' ' A' ' 6' ' ' PHE . 88.7 mt -134.08 154.68 51.02 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.015 -1.053 . . . . 0.0 109.722 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -86.2 104.01 15.35 Favored 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.194 -0.941 . . . . 0.0 110.502 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.407 ' HA3' HG23 ' A' ' 8' ' ' VAL . . . 148.2 -36.77 1.1 Allowed Glycine 0 N--CA 1.493 2.498 0 C-N-CA 119.766 -1.207 . . . . 0.0 110.893 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.459 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 17.3 p-90 -57.88 -35.23 70.7 Favored 'General case' 0 N--CA 1.509 2.511 0 CA-C-N 119.034 1.417 . . . . 0.0 110.838 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.459 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 1.9 tp10 -74.92 -29.38 60.95 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.021 -1.05 . . . . 0.0 110.862 179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -99.01 -25.59 14.51 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.917 -1.114 . . . . 0.0 112.004 -179.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.558 HD13 ' CD2' ' A' ' 10' ' ' TYR . 64.2 mt -76.21 -175.57 3.22 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 120.679 -1.263 . . . . 0.0 110.273 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -63.31 152.74 37.04 Favored 'General case' 0 N--CA 1.509 2.497 0 O-C-N 121.188 -0.945 . . . . 0.0 110.345 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -88.26 -40.18 13.85 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.189 -0.944 . . . . 0.0 110.22 179.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 80.5 m-20 -60.17 -51.51 69.26 Favored 'General case' 0 N--CA 1.508 2.471 0 O-C-N 121.218 -0.926 . . . . 0.0 109.842 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.449 ' CB ' ' OH ' ' A' ' 10' ' ' TYR . 42.8 mt-10 -61.49 -40.0 92.99 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.254 -0.903 . . . . 0.0 109.326 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.666 ' HA ' HD12 ' A' ' 90' ' ' ILE . 1.2 tmmt? -59.56 -41.07 89.32 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.328 -0.857 . . . . 0.0 109.535 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -54.54 -33.6 60.37 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.209 -0.932 . . . . 0.0 110.364 179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -57.63 -37.62 73.61 Favored 'General case' 0 N--CA 1.51 2.542 0 O-C-N 120.994 -1.066 . . . . 0.0 110.206 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.666 HD12 ' HA ' ' A' ' 87' ' ' LYS . 7.2 mt -62.36 -36.79 76.5 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.459 0 O-C-N 121.119 -0.988 . . . . 0.0 109.511 179.326 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.536 ' OG1' HD22 ' A' ' 73' ' ' LEU . 28.0 m -58.15 -38.13 76.01 Favored 'General case' 0 N--CA 1.51 2.56 0 O-C-N 120.899 -1.125 . . . . 0.0 109.6 179.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -57.79 -38.11 74.9 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.302 -0.874 . . . . 0.0 109.765 179.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.531 ' ND1' HG22 ' A' ' 53' ' ' ILE . 5.7 m-70 -58.56 -53.5 57.58 Favored 'General case' 0 N--CA 1.509 2.475 0 O-C-N 121.089 -1.007 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.5 mp -61.92 -38.42 80.62 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.402 0 C-N-CA 119.39 -0.924 . . . . 0.0 109.396 179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.97 -38.95 92.67 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.176 -0.952 . . . . 0.0 109.774 179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -60.94 -39.33 89.07 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.157 -0.964 . . . . 0.0 109.798 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 7.6 mp -72.02 -34.58 68.94 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.226 -0.921 . . . . 0.0 110.349 179.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 32.5 t -101.07 62.84 0.98 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.025 -1.047 . . . . 0.0 110.197 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 35.1 t -132.5 40.18 3.31 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.144 -0.972 . . . . 0.0 110.223 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -141.63 134.2 28.38 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.085 -1.009 . . . . 0.0 110.227 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -141.32 123.55 15.65 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.13 -0.981 . . . . 0.0 110.248 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -144.24 77.99 1.56 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.211 -0.931 . . . . 0.0 110.189 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 71.42 133.81 0.12 Allowed Glycine 0 N--CA 1.494 2.537 0 N-CA-C 109.384 -1.487 . . . . 0.0 109.384 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 23.6 m -143.6 60.94 9.13 Favored Pre-proline 0 N--CA 1.495 1.777 0 O-C-N 121.2 -1.177 . . . . 0.0 110.319 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.91 119.06 5.85 Favored 'Trans proline' 0 C--N 1.318 -1.079 0 O-C-N 123.365 1.192 . . . . 0.0 110.322 179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -143.28 149.1 37.39 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.175 -0.953 . . . . 0.0 110.409 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -134.98 141.61 46.28 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.294 -0.879 . . . . 0.0 110.142 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -120.9 96.91 5.29 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.097 -1.002 . . . . 0.0 110.248 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -128.28 109.8 11.8 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.249 -0.907 . . . . 0.0 110.122 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.6 t -127.54 122.2 58.73 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.216 -0.928 . . . . 0.0 109.969 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.4 t -133.24 106.04 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.205 -0.934 . . . . 0.0 109.99 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -132.82 110.95 10.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.18 -0.95 . . . . 0.0 110.156 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.29 122.04 41.92 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.119 -0.988 . . . . 0.0 110.223 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 17.6 mttt -123.18 121.69 36.57 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.274 -0.891 . . . . 0.0 110.142 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.8 tp -117.74 137.04 52.97 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.211 -0.931 . . . . 0.0 110.222 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -141.63 111.18 6.49 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.309 -0.869 . . . . 0.0 110.131 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.568 ' O ' HG22 ' A' ' 117' ' ' THR . 25.1 m . . . . . 0 N--CA 1.494 1.772 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.198 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.5 ptt? . . . . . 0 N--CA 1.493 1.708 0 CA-C-O 120.736 0.303 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -116.9 142.84 46.42 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.149 -0.969 . . . . 0.0 110.188 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -123.43 -61.45 1.4 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.239 -0.913 . . . . 0.0 110.267 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.8 tt0 -134.95 116.43 14.7 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.217 -0.927 . . . . 0.0 110.194 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.1 mtp85 -120.06 145.66 46.65 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.185 -0.947 . . . . 0.0 110.273 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.522 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.4 m-85 -125.37 142.38 51.53 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.301 -0.874 . . . . 0.0 110.133 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.3 t -125.66 157.51 37.09 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.239 -0.913 . . . . 0.0 109.938 179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.405 HG12 ' CD1' ' A' ' 82' ' ' LEU . 52.0 t -113.31 116.72 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.917 0 O-C-N 121.121 -0.987 . . . . 0.0 110.03 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.442 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 3.9 t70 -123.72 148.44 46.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.143 -0.973 . . . . 0.0 110.113 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.719 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -105.3 142.48 34.99 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.273 -0.892 . . . . 0.0 109.646 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -58.66 126.94 29.72 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.123 -0.986 . . . . 0.0 110.355 -179.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -137.85 109.28 6.93 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.299 -0.876 . . . . 0.0 110.143 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 37.69 41.56 0.32 Allowed 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.62 164.77 26.62 Favored Glycine 0 N--CA 1.494 2.525 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 44.3 m -144.4 122.43 12.1 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.124 -1.221 . . . . 0.0 110.347 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -153.21 139.44 18.43 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.185 -0.947 . . . . 0.0 111.133 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.99 129.13 49.1 Favored Glycine 0 N--CA 1.495 2.631 0 N-CA-C 108.906 -1.677 . . . . 0.0 108.906 179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.451 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 32.0 p -66.79 119.84 12.51 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.156 -1.202 . . . . 0.0 111.118 -178.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 12.6 mmtp -68.25 159.41 31.3 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.271 -0.893 . . . . 0.0 109.192 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.2 tptt 63.59 19.38 11.68 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.524 -1.36 . . . . 0.0 110.757 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.5 p -177.47 153.42 0.91 Allowed 'General case' 0 N--CA 1.505 2.308 0 O-C-N 120.575 -1.328 . . . . 0.0 110.716 178.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 tttm -91.83 86.71 5.99 Favored 'General case' 0 N--CA 1.512 2.638 0 O-C-N 121.011 -1.055 . . . . 0.0 111.65 -178.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -165.51 -172.52 2.46 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.278 -0.889 . . . . 0.0 110.516 179.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.9 ttpt -127.65 155.9 43.18 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.139 -0.976 . . . . 0.0 109.978 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.572 HD11 ' O ' ' A' ' 50' ' ' TRP . 70.5 mt -107.25 124.96 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.041 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 29' ' ' VAL . 34.1 m -130.29 156.13 42.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 O-C-N 121.233 -0.917 . . . . 0.0 110.144 179.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 14.8 ttpt -48.96 129.22 17.14 Favored 'General case' 0 N--CA 1.515 2.786 0 O-C-N 121.336 -0.853 . . . . 0.0 110.855 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 116.83 -8.26 16.84 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.573 -179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.658 HG12 ' O ' ' A' ' 26' ' ' VAL . 7.3 p -125.09 134.85 65.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.977 0 CA-C-N 119.795 1.797 . . . . 0.0 110.572 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 30.7 p -76.86 142.74 40.08 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.071 -1.018 . . . . 0.0 110.245 -179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.473 ' HD3' HG21 ' A' ' 25' ' ' ILE . 5.6 ptt180 -136.42 146.33 46.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.16 -0.962 . . . . 0.0 110.381 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.436 ' O ' ' CE1' ' A' ' 51' ' ' TYR . 30.6 mt -113.81 132.69 62.08 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 O-C-N 121.287 -0.883 . . . . 0.0 109.902 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.424 ' HA2' ' O ' ' A' ' 49' ' ' GLU . . . -108.8 155.5 16.08 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.0 ttpm? -118.26 130.74 56.23 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.187 -1.184 . . . . 0.0 109.781 -179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.497 HG22 ' HB3' ' A' ' 48' ' ' LYS . 61.7 t -104.24 107.96 23.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.121 -0.987 . . . . 0.0 109.983 179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.427 HG23 ' HD2' ' A' ' 37' ' ' PRO . 10.3 p -123.97 143.33 42.0 Favored Pre-proline 0 N--CA 1.494 1.772 0 O-C-N 121.221 -0.925 . . . . 0.0 110.027 179.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.427 ' HD2' HG23 ' A' ' 36' ' ' VAL . 45.9 Cg_endo -72.12 146.91 47.42 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 O-C-N 123.228 1.12 . . . . 0.0 110.331 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -102.53 158.6 31.44 Favored Pre-proline 0 N--CA 1.5 2.071 0 O-C-N 121.288 -0.883 . . . . 0.0 110.241 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.93 70.71 3.56 Favored 'Trans proline' 0 C--N 1.317 -1.101 0 O-C-N 123.425 1.224 . . . . 0.0 110.379 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -151.38 -58.61 0.16 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.24 -0.913 . . . . 0.0 110.428 -179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -115.22 156.59 25.08 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.209 -0.932 . . . . 0.0 110.165 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -101.48 -48.96 4.17 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.198 -0.939 . . . . 0.0 110.198 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.5 t -60.83 -40.41 92.67 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.219 -0.926 . . . . 0.0 109.981 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -136.35 -155.67 7.2 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 101.06 49.66 1.32 Allowed Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.692 -1.363 . . . . 0.0 109.692 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -117.0 131.63 56.91 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.221 -1.164 . . . . 0.0 110.127 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.6 tpt -117.31 151.66 36.5 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.096 -1.002 . . . . 0.0 110.423 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.497 ' HB3' HG22 ' A' ' 35' ' ' VAL . 18.8 pttt -131.3 141.93 50.03 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.271 -0.893 . . . . 0.0 110.163 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.424 ' O ' ' HA2' ' A' ' 33' ' ' GLY . 80.3 mt-10 -120.08 164.58 15.95 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.13 -0.981 . . . . 0.0 109.757 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.572 ' O ' HD11 ' A' ' 25' ' ' ILE . 18.3 m95 -113.9 128.25 56.32 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.065 -1.022 . . . . 0.0 110.735 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.522 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 7.0 p90 -151.94 173.42 14.85 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.492 177.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.451 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 47.9 m80 -80.91 176.71 9.58 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.579 -0.701 . . . . 0.0 112.555 -176.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.493 HG23 ' CE2' ' A' ' 57' ' ' PHE . 21.1 mt -88.73 -53.95 8.67 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 178.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -54.72 -36.53 64.84 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.053 -1.029 . . . . 0.0 109.583 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 7.2 m -63.02 -51.68 65.86 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.313 -0.867 . . . . 0.0 109.15 178.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.539 ' O ' HD13 ' A' ' 60' ' ' LEU . 7.5 tpt -69.03 -42.35 76.49 Favored 'General case' 0 N--CA 1.505 2.313 0 C-N-CA 119.736 -0.786 . . . . 0.0 109.459 179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.493 ' CE2' HG23 ' A' ' 53' ' ' ILE . 12.8 m-85 -67.46 -30.57 70.32 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.511 -0.876 . . . . 0.0 109.981 179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -73.94 -40.79 62.82 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.859 -1.15 . . . . 0.0 109.059 178.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -58.66 -39.31 80.26 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.244 -0.91 . . . . 0.0 109.369 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 56' ' ' MET . 6.7 mp -53.59 -41.87 67.05 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.158 -0.964 . . . . 0.0 109.263 178.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -59.5 -36.08 75.37 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.257 -0.902 . . . . 0.0 109.5 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -109.18 33.2 4.41 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.229 -0.92 . . . . 0.0 110.345 179.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -101.11 169.37 8.98 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 120.981 -1.075 . . . . 0.0 110.499 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 4.9 ttt-85 -62.26 158.31 17.49 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.225 -0.922 . . . . 0.0 110.324 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.77 -31.59 72.33 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.222 -0.924 . . . . 0.0 111.109 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.4 p -95.98 53.18 1.36 Allowed 'General case' 0 N--CA 1.504 2.266 0 O-C-N 120.849 -1.157 . . . . 0.0 110.393 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.1 m -116.97 163.29 16.44 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.097 -1.002 . . . . 0.0 110.067 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 30.4 mttm -94.8 145.41 24.9 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.151 -0.968 . . . . 0.0 109.712 179.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.435 ' HB2' HD23 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -128.92 161.68 29.3 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.236 -0.915 . . . . 0.0 110.816 -179.391 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.7 mt -89.52 124.0 42.01 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.227 0 O-C-N 121.255 -0.903 . . . . 0.0 109.877 179.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -116.36 148.25 40.8 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.263 -0.898 . . . . 0.0 110.188 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 54.14 177.34 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.079 -1.013 . . . . 0.0 110.683 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.752 HD13 ' CG2' ' A' ' 90' ' ' ILE . 61.5 tp -127.85 87.81 2.67 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.207 -0.933 . . . . 0.0 110.368 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.613 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -172.38 -51.35 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.291 0 O-C-N 121.199 -0.938 . . . . 0.0 110.84 179.686 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -50.87 -35.65 33.86 Favored 'General case' 0 N--CA 1.513 2.716 0 O-C-N 121.027 -1.046 . . . . 0.0 110.603 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.15 150.89 44.71 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.131 -0.981 . . . . 0.0 109.659 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -101.96 123.51 45.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.18 -0.95 . . . . 0.0 110.174 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 135.78 -36.86 1.97 Allowed Glycine 0 N--CA 1.493 2.466 0 N-CA-C 110.212 -1.155 . . . . 0.0 110.212 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.47 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 43.0 p-90 -56.37 -37.37 69.97 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.939 -1.33 . . . . 0.0 110.685 -179.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.47 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 2.9 tm-20 -71.87 -37.41 70.21 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.068 -1.02 . . . . 0.0 109.775 179.383 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -66.7 -29.14 69.07 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.184 -0.947 . . . . 0.0 111.037 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.719 HD13 ' CD2' ' A' ' 10' ' ' TYR . 85.0 mt -81.39 -173.77 4.55 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.851 -1.155 . . . . 0.0 110.262 -179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -63.54 162.36 12.96 Favored 'General case' 0 N--CA 1.509 2.484 0 O-C-N 121.204 -0.935 . . . . 0.0 110.469 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -86.6 -41.1 14.55 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.273 -0.892 . . . . 0.0 110.137 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -60.83 -47.62 85.53 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 121.267 -0.895 . . . . 0.0 109.435 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.431 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 17.6 mt-10 -60.61 -39.05 86.76 Favored 'General case' 0 N--CA 1.508 2.442 0 C-N-CA 119.528 -0.869 . . . . 0.0 109.356 178.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.61 ' HG2' HD21 ' A' ' 73' ' ' LEU . 6.1 ttpt -56.17 -40.09 73.35 Favored 'General case' 0 N--CA 1.511 2.588 0 O-C-N 121.257 -0.902 . . . . 0.0 109.788 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -56.93 -36.07 69.79 Favored 'General case' 0 N--CA 1.511 2.607 0 O-C-N 121.296 -0.877 . . . . 0.0 110.218 179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -59.58 -36.14 75.65 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.002 -1.061 . . . . 0.0 110.424 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.752 ' CG2' HD13 ' A' ' 73' ' ' LEU . 53.4 mt -65.26 -40.08 87.46 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.03 -1.044 . . . . 0.0 109.565 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -60.57 -44.37 96.26 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.026 -1.046 . . . . 0.0 109.081 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -64.82 -39.63 93.89 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.489 ' NE2' HG22 ' A' ' 53' ' ' ILE . 16.8 t60 -57.08 -48.0 79.65 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.23 -0.919 . . . . 0.0 109.742 179.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.429 HG12 ' CZ ' ' A' ' 57' ' ' PHE . 11.6 mt -65.09 -38.49 82.86 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.281 -0.967 . . . . 0.0 109.132 179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.12 84.79 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.189 -0.944 . . . . 0.0 109.666 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -61.05 -37.38 82.42 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.236 -0.915 . . . . 0.0 110.002 179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.476 HD22 ' HD1' ' A' ' 57' ' ' PHE . 19.6 tp -81.42 -38.27 26.76 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.061 -1.024 . . . . 0.0 110.112 179.695 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 30.4 t -74.61 -38.25 62.63 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.066 -1.021 . . . . 0.0 110.082 179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -111.32 165.11 12.23 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.136 -0.977 . . . . 0.0 110.03 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -123.47 174.53 7.32 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.129 -0.982 . . . . 0.0 110.315 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -132.8 -165.15 1.56 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.283 -0.885 . . . . 0.0 110.177 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.16 166.17 12.33 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.183 -0.948 . . . . 0.0 110.173 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -77.54 138.3 21.48 Favored Glycine 0 N--CA 1.492 2.428 0 N-CA-C 109.548 -1.421 . . . . 0.0 109.548 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 7.8 t -141.19 146.89 44.9 Favored Pre-proline 0 N--CA 1.495 1.786 0 O-C-N 121.267 -1.137 . . . . 0.0 110.296 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.99 83.96 1.36 Allowed 'Trans proline' 0 C--N 1.318 -1.07 0 O-C-N 123.314 1.165 . . . . 0.0 110.442 -179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.9 tttt 52.7 86.37 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.076 -1.015 . . . . 0.0 110.805 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 12.1 tttt -134.1 46.74 2.48 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.189 -0.944 . . . . 0.0 110.17 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -121.68 92.08 3.66 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.136 -0.977 . . . . 0.0 110.28 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.32 162.74 17.42 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.15 -0.969 . . . . 0.0 110.179 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.64 147.27 33.13 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.279 -0.888 . . . . 0.0 110.21 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.9 t -117.84 143.06 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.199 -0.938 . . . . 0.0 109.933 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -117.17 123.47 46.78 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.22 -0.925 . . . . 0.0 110.224 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.73 141.36 48.69 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.156 -0.965 . . . . 0.0 110.13 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -116.0 102.82 9.99 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.233 -0.917 . . . . 0.0 110.15 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.457 HD22 ' HA ' ' A' ' 115' ' ' LEU . 0.1 OUTLIER -120.68 120.01 34.48 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.216 -0.928 . . . . 0.0 110.177 179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 29.6 m -125.98 124.18 40.16 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.212 -0.93 . . . . 0.0 110.19 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 12.1 p . . . . . 0 N--CA 1.495 1.789 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.224 -179.984 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 ttt . . . . . 0 N--CA 1.492 1.637 0 N-CA-C 110.159 -0.311 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -121.24 -173.76 2.69 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.126 -0.984 . . . . 0.0 110.202 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -147.27 84.13 1.57 Allowed 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.224 -0.922 . . . . 0.0 110.437 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -125.84 141.83 51.8 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.157 -0.964 . . . . 0.0 110.227 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.55 139.51 52.83 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.16 -0.962 . . . . 0.0 110.143 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.505 ' HE1' ' HH ' ' A' ' 51' ' ' TYR . 1.9 m-85 -119.74 154.66 33.83 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.182 -0.948 . . . . 0.0 110.326 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 84.1 m -143.76 134.29 24.84 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.318 -0.864 . . . . 0.0 110.298 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.783 HG23 HD23 ' A' ' 76' ' ' LEU . 47.7 t -102.5 105.76 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 O-C-N 121.223 -0.923 . . . . 0.0 109.671 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -118.02 159.45 23.18 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.14 -0.975 . . . . 0.0 110.874 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.73 149.1 27.65 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.545 -0.722 . . . . 0.0 109.637 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -79.43 123.74 27.8 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.173 -0.954 . . . . 0.0 109.953 179.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.8 mttt -149.65 39.36 0.79 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.183 -0.948 . . . . 0.0 110.588 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -136.38 -66.03 0.55 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.215 -0.928 . . . . 0.0 110.156 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -153.69 -137.67 2.52 Favored Glycine 0 N--CA 1.497 2.745 0 N-CA-C 110.064 -1.215 . . . . 0.0 110.064 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.946 HG22 HG12 ' A' ' 26' ' ' VAL . 70.3 p -122.78 116.22 23.35 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.231 -1.158 . . . . 0.0 110.038 179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -122.67 134.67 54.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.131 -0.981 . . . . 0.0 110.653 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.27 123.12 31.55 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 108.527 -1.829 . . . . 0.0 108.527 179.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.493 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 26.3 p -64.59 129.09 38.5 Favored 'General case' 0 N--CA 1.502 2.135 0 O-C-N 121.29 -1.123 . . . . 0.0 110.914 -178.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.442 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 35.5 mmtt -75.45 156.02 35.7 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.578 -0.701 . . . . 0.0 109.251 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 65.76 15.82 10.22 Favored 'General case' 0 N--CA 1.507 2.377 0 O-C-N 120.85 -1.156 . . . . 0.0 111.704 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.402 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 8.8 p -174.91 151.27 1.35 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.557 -1.339 . . . . 0.0 110.752 178.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -87.1 90.73 8.46 Favored 'General case' 0 N--CA 1.514 2.739 0 O-C-N 121.053 -1.029 . . . . 0.0 111.647 -177.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.436 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 0.4 OUTLIER -167.62 -174.0 2.35 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.332 -0.855 . . . . 0.0 110.412 178.947 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 51.2 mttt -126.08 154.03 43.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.989 -1.07 . . . . 0.0 110.036 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.556 HD13 ' HD3' ' A' ' 31' ' ' ARG . 80.4 mt -109.86 103.09 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.952 0 O-C-N 121.404 -0.81 . . . . 0.0 109.912 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.946 HG12 HG22 ' A' ' 15' ' ' THR . 22.9 m -110.98 162.98 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.98 0 O-C-N 121.259 -0.901 . . . . 0.0 110.397 179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 79.5 mttt -49.6 137.27 15.73 Favored 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.415 -0.803 . . . . 0.0 111.033 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.86 7.36 50.74 Favored Glycine 0 N--CA 1.495 2.612 0 C-N-CA 120.184 -1.007 . . . . 0.0 111.499 -179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.651 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.1 p -126.86 137.36 58.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.73 1.765 . . . . 0.0 110.786 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.495 ' SG ' HD21 ' A' ' 82' ' ' LEU . 42.3 t -93.49 138.98 31.25 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.237 -0.914 . . . . 0.0 109.774 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.556 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.1 ptt180 -135.09 147.78 49.64 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.258 -0.901 . . . . 0.0 110.348 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.436 HG22 ' HD1' ' A' ' 6' ' ' PHE . 15.1 mt -106.33 123.83 61.34 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.313 -0.867 . . . . 0.0 109.523 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -103.24 137.22 13.32 Favored Glycine 0 N--CA 1.492 2.421 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.458 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 37.4 ttpt -107.26 124.2 49.42 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.233 -1.157 . . . . 0.0 109.379 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 53.4 t -99.98 114.45 38.48 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.069 -1.019 . . . . 0.0 110.321 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.2 p -121.82 138.18 28.26 Favored Pre-proline 0 N--CA 1.496 1.854 0 O-C-N 121.292 -0.88 . . . . 0.0 110.345 179.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -76.2 151.28 34.1 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 O-C-N 123.003 1.002 . . . . 0.0 110.458 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -102.84 162.75 19.2 Favored Pre-proline 0 N--CA 1.5 2.025 0 O-C-N 121.298 -0.876 . . . . 0.0 110.088 179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.08 -43.12 1.24 Allowed 'Trans proline' 0 C--N 1.317 -1.105 0 O-C-N 123.348 1.183 . . . . 0.0 110.334 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -126.1 98.93 5.68 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.235 -0.915 . . . . 0.0 110.038 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.421 ' OG ' ' HA2' ' A' ' 45' ' ' GLY . 9.5 p -140.22 125.25 18.52 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.227 -0.92 . . . . 0.0 110.205 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -102.55 -54.19 2.72 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 121.204 -0.935 . . . . 0.0 110.135 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.22 -40.9 12.54 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 121.224 -0.922 . . . . 0.0 110.107 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -80.29 -108.83 0.28 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.655 -1.378 . . . . 0.0 109.655 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.421 ' HA2' ' OG ' ' A' ' 41' ' ' SER . . . 123.68 -64.83 0.53 Allowed Glycine 0 N--CA 1.494 2.528 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -114.76 143.83 44.44 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.255 -1.144 . . . . 0.0 109.986 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 mmt -116.82 139.08 51.02 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.172 -0.955 . . . . 0.0 110.285 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.437 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 6.1 ttmm -129.37 130.64 46.29 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.276 -0.89 . . . . 0.0 110.128 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -114.68 138.74 50.34 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.204 -0.935 . . . . 0.0 109.82 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 11.5 m95 -93.98 112.76 24.63 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.191 -0.943 . . . . 0.0 110.852 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.505 ' HH ' ' HE1' ' A' ' 6' ' ' PHE . 0.7 OUTLIER -123.54 170.93 9.92 Favored 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 119.223 -0.991 . . . . 0.0 109.47 177.064 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.0 m80 -88.97 -173.88 4.25 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.442 -0.786 . . . . 0.0 110.338 -179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.558 HG22 ' CE1' ' A' ' 93' ' ' HIS . 34.7 mm -83.22 -54.61 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.49 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 tttp -60.07 -37.5 80.05 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.292 -0.88 . . . . 0.0 109.398 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.402 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 19.4 m -60.75 -51.22 70.28 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.208 -0.932 . . . . 0.0 109.14 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 11.3 tpt -69.21 -45.43 69.87 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.365 179.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.43 ' CE2' ' HB3' ' A' ' 93' ' ' HIS . 11.2 m-85 -63.21 -29.88 71.13 Favored 'General case' 0 N--CA 1.502 2.145 0 C-N-CA 119.212 -0.995 . . . . 0.0 109.833 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -62.84 -41.55 99.39 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.885 -1.134 . . . . 0.0 109.122 178.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -40.88 92.11 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.226 -0.921 . . . . 0.0 108.927 178.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.9 mp -55.78 -41.71 74.49 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.139 -0.976 . . . . 0.0 109.237 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -58.26 -35.45 71.76 Favored 'General case' 0 N--CA 1.509 2.481 0 O-C-N 121.314 -0.866 . . . . 0.0 109.581 178.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.7 mmt85 -105.97 31.16 5.27 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.196 -0.94 . . . . 0.0 110.544 179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.94 168.5 9.43 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.987 -1.071 . . . . 0.0 110.086 179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -62.9 153.83 32.16 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.217 -0.927 . . . . 0.0 110.09 -179.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.88 -34.46 19.42 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.22 -0.925 . . . . 0.0 110.65 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.38 -35.78 40.33 Favored 'General case' 0 N--CA 1.513 2.714 0 O-C-N 120.96 -1.087 . . . . 0.0 110.91 -179.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 20.8 m -110.98 132.68 54.0 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.112 -0.993 . . . . 0.0 110.302 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -117.51 144.87 44.64 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.18 -0.95 . . . . 0.0 110.188 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.87 137.53 51.54 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.192 -0.943 . . . . 0.0 110.284 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.3 mt 54.21 99.07 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.08 -1.013 . . . . 0.0 110.782 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -107.43 139.18 42.32 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.188 -0.945 . . . . 0.0 109.403 179.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 54.62 -163.99 0.12 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.964 -1.085 . . . . 0.0 110.053 -179.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.648 HD21 ' HG3' ' A' ' 87' ' ' LYS . 56.4 tp -116.08 70.84 0.76 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.034 -1.041 . . . . 0.0 110.473 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.68 -163.7 0.34 Allowed 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.229 -0.92 . . . . 0.0 110.314 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 54.44 37.45 27.76 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.996 -1.065 . . . . 0.0 110.259 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.783 HD23 HG23 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -145.22 151.53 38.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.197 -0.94 . . . . 0.0 109.74 -179.774 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -94.49 97.18 9.97 Favored 'General case' 0 N--CA 1.501 2.116 0 O-C-N 121.123 -0.985 . . . . 0.0 109.99 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 150.12 -36.56 0.95 Allowed Glycine 0 N--CA 1.495 2.627 0 C-N-CA 119.72 -1.229 . . . . 0.0 110.752 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 52.8 p-90 -56.01 -34.78 66.14 Favored 'General case' 0 N--CA 1.511 2.611 0 CA-C-N 118.921 1.36 . . . . 0.0 110.616 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -63.41 -43.81 96.42 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.052 -1.03 . . . . 0.0 109.439 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -60.45 -39.75 88.68 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.14 -0.975 . . . . 0.0 109.75 179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.551 ' CD2' HD11 ' A' ' 90' ' ' ILE . 3.5 mp -49.38 173.56 0.02 OUTLIER 'General case' 0 N--CA 1.517 2.907 0 O-C-N 121.219 -0.926 . . . . 0.0 110.643 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -101.23 161.0 13.93 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.069 -1.019 . . . . 0.0 110.383 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -55.59 -36.18 66.61 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.181 -0.949 . . . . 0.0 110.967 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -70.41 -43.48 69.9 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 121.063 -1.023 . . . . 0.0 109.452 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.41 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 22.2 mt-10 -70.64 -39.35 73.71 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 119.446 -0.902 . . . . 0.0 108.839 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.648 ' HG3' HD21 ' A' ' 73' ' ' LEU . 26.0 tttt -61.81 -37.43 84.38 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.286 -0.884 . . . . 0.0 109.853 179.121 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -65.91 -40.25 91.32 Favored 'General case' 0 N--CA 1.508 2.442 0 O-C-N 121.149 -0.969 . . . . 0.0 109.744 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -62.92 -35.33 79.72 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.241 -0.912 . . . . 0.0 110.538 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.6 HG22 HD13 ' A' ' 73' ' ' LEU . 98.5 mt -68.19 -36.99 77.37 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 O-C-N 121.113 -0.992 . . . . 0.0 109.434 179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.43 -38.92 88.89 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 120.886 -1.134 . . . . 0.0 109.451 179.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -57.39 -37.96 73.51 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.164 -0.96 . . . . 0.0 109.874 179.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.558 ' CE1' HG22 ' A' ' 53' ' ' ILE . 2.7 m-70 -55.01 -47.8 74.2 Favored 'General case' 0 N--CA 1.511 2.598 0 O-C-N 121.116 -0.99 . . . . 0.0 110.066 179.727 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 3.0 mp -66.0 -38.89 83.1 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 O-C-N 121.238 -0.914 . . . . 0.0 109.197 179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.06 -39.26 79.21 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.186 -0.946 . . . . 0.0 109.696 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -65.8 -36.97 85.01 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.168 -0.958 . . . . 0.0 109.903 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 28.2 tp -82.31 -30.9 30.24 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.066 -1.021 . . . . 0.0 110.646 179.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 46.8 t -101.26 55.78 0.84 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 120.869 -1.145 . . . . 0.0 110.263 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 48.9 p -135.57 77.14 1.65 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.077 -1.015 . . . . 0.0 110.247 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 41.8 tttt -143.58 -59.19 0.41 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.183 -0.948 . . . . 0.0 110.34 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -145.09 40.11 1.23 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.148 -0.97 . . . . 0.0 110.297 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -140.42 -167.45 2.34 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.145 -0.972 . . . . 0.0 110.215 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.42 ' O ' ' OG1' ' A' ' 104' ' ' THR . . . 115.53 91.76 1.76 Allowed Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 103' ' ' GLY . 82.6 p 46.61 89.75 0.09 OUTLIER Pre-proline 0 N--CA 1.504 2.246 0 O-C-N 121.324 -1.103 . . . . 0.0 111.436 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -73.19 -40.38 1.72 Allowed 'Trans proline' 0 C--N 1.316 -1.138 0 O-C-N 123.471 1.248 . . . . 0.0 110.417 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -132.0 -179.38 5.37 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.208 -0.933 . . . . 0.0 110.368 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 23.7 tttm -141.68 170.43 15.73 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.247 -0.908 . . . . 0.0 110.138 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 17.9 tptt -141.6 84.41 1.9 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.117 -0.99 . . . . 0.0 110.284 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.47 143.92 45.55 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.282 -0.886 . . . . 0.0 110.22 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 9.0 p -130.52 146.35 34.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.213 -0.929 . . . . 0.0 110.206 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.7 p -138.21 144.68 29.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.133 -0.979 . . . . 0.0 110.287 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -118.16 104.93 11.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.191 -0.943 . . . . 0.0 110.227 -179.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.11 141.34 48.39 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.137 -0.977 . . . . 0.0 110.229 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -115.92 101.32 8.67 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.146 -0.971 . . . . 0.0 110.317 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 4.9 tp -117.65 150.21 39.42 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.205 -0.935 . . . . 0.0 110.072 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 3.4 p -134.94 109.19 8.31 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.179 -0.951 . . . . 0.0 110.275 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 118.026 -0.987 . . . . 0.0 110.194 179.967 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -127.27 49.03 2.14 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.306 -0.871 . . . . 0.0 110.152 -179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -121.54 161.57 22.1 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.14 -0.975 . . . . 0.0 110.283 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -117.33 139.18 51.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.205 -0.934 . . . . 0.0 110.173 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.76 126.18 51.98 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.233 -0.917 . . . . 0.0 110.177 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.822 ' HB3' HD11 ' A' ' 76' ' ' LEU . 1.5 m-85 -116.18 143.95 44.82 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.171 -0.956 . . . . 0.0 110.059 179.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.5 p -141.03 138.32 33.58 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.237 -0.914 . . . . 0.0 109.877 179.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.76 HG13 ' CD2' ' A' ' 76' ' ' LEU . 21.7 m -104.53 140.5 22.42 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.093 -1.004 . . . . 0.0 110.222 179.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -142.28 156.05 45.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.245 -0.909 . . . . 0.0 110.335 -179.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -107.35 154.07 21.83 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.359 -0.838 . . . . 0.0 109.792 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.532 ' HB3' ' HA ' ' A' ' 27' ' ' LYS . . . -82.33 142.27 32.18 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.243 -0.911 . . . . 0.0 110.058 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.8 mmtt -143.51 -59.86 0.41 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.292 -0.88 . . . . 0.0 110.163 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.62 84.57 2.25 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.194 -0.941 . . . . 0.0 110.251 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 141.34 174.82 14.51 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.543 HG22 HG12 ' A' ' 26' ' ' VAL . 55.3 p -140.68 139.18 34.72 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.184 -1.186 . . . . 0.0 110.204 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -123.42 150.77 43.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.214 -0.929 . . . . 0.0 110.677 -179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -85.08 120.13 5.22 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 -179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.6 t -64.71 122.52 17.07 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.262 -1.14 . . . . 0.0 109.732 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.83 148.05 44.52 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.057 -1.027 . . . . 0.0 108.669 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.8 mtpp 53.0 64.93 1.67 Allowed 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.906 -1.121 . . . . 0.0 108.949 -178.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 49.0 t -172.94 -43.65 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.221 -0.924 . . . . 0.0 112.555 -177.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tttm 70.06 44.85 0.75 Allowed 'General case' 0 N--CA 1.505 2.302 0 O-C-N 120.884 -1.135 . . . . 0.0 108.202 -177.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.72 -168.38 2.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.556 -0.715 . . . . 0.0 109.49 -179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -137.22 157.5 46.52 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.984 -1.073 . . . . 0.0 110.42 -179.151 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.591 HG23 HG13 ' A' ' 29' ' ' VAL . 69.5 mt -110.95 110.28 31.62 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.402 -0.811 . . . . 0.0 109.826 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.798 ' O ' HG12 ' A' ' 29' ' ' VAL . 24.4 m -110.11 169.39 3.67 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 O-C-N 121.187 -0.946 . . . . 0.0 110.614 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HA ' ' HB3' ' A' ' 11' ' ' ALA . 35.8 tttt -46.6 138.61 5.8 Favored 'General case' 0 N--CA 1.515 2.813 0 O-C-N 121.56 -0.712 . . . . 0.0 111.136 -179.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 107.57 -23.16 27.02 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 119.968 -1.11 . . . . 0.0 110.533 -179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.798 HG12 ' O ' ' A' ' 26' ' ' VAL . 14.8 p -113.52 137.59 46.11 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 CA-C-N 119.151 1.475 . . . . 0.0 110.318 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.655 ' HB3' HD11 ' A' ' 53' ' ' ILE . 44.8 t -91.17 142.43 27.75 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.045 -1.035 . . . . 0.0 110.199 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.449 ' HD2' ' CD2' ' A' ' 50' ' ' TRP . 1.1 ptt180 -128.16 153.3 47.03 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.143 -0.973 . . . . 0.0 110.533 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.413 HD12 ' HG2' ' A' ' 56' ' ' MET . 11.4 mt -111.95 137.26 45.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.0 0 O-C-N 121.344 -0.847 . . . . 0.0 110.414 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.414 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.09 129.2 9.58 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 108.348 -1.901 . . . . 0.0 108.348 178.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.45 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 33.6 ttpt -110.15 116.96 32.47 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.069 -1.253 . . . . 0.0 110.395 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.6 t -109.24 109.4 28.23 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 O-C-N 121.222 -0.924 . . . . 0.0 110.017 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.3 t -120.53 112.57 34.03 Favored Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 121.215 -0.928 . . . . 0.0 109.961 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.3 133.75 19.82 Favored 'Trans proline' 0 C--N 1.32 -0.941 0 O-C-N 123.119 1.063 . . . . 0.0 110.393 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -103.48 118.84 56.67 Favored Pre-proline 0 N--CA 1.5 2.049 0 O-C-N 121.203 -0.935 . . . . 0.0 110.028 179.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.6 71.08 3.27 Favored 'Trans proline' 0 N--CA 1.485 1.021 0 O-C-N 123.186 1.098 . . . . 0.0 110.396 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -150.49 -58.59 0.18 Allowed 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.129 -0.982 . . . . 0.0 110.468 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -113.67 157.11 22.59 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.161 -0.962 . . . . 0.0 110.229 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -96.02 -39.22 9.86 Favored 'General case' 0 N--CA 1.504 2.226 0 O-C-N 121.248 -0.908 . . . . 0.0 110.461 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.7 m -57.23 -39.69 76.03 Favored 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.048 -1.032 . . . . 0.0 110.167 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -74.15 -60.85 3.42 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 109.432 -1.467 . . . . 0.0 109.432 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.22 -99.48 0.8 Allowed Glycine 0 N--CA 1.493 2.48 0 N-CA-C 109.701 -1.36 . . . . 0.0 109.701 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -133.33 147.41 51.84 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.167 -1.196 . . . . 0.0 110.331 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 17.7 mtt -115.27 143.58 45.04 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.167 -0.958 . . . . 0.0 110.198 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -118.6 123.88 46.08 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.225 -0.922 . . . . 0.0 110.284 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -116.66 137.21 52.36 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.181 -0.949 . . . . 0.0 109.897 179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 26.7 m95 -92.84 134.48 35.04 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 121.219 -0.925 . . . . 0.0 109.998 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -121.71 176.01 5.95 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.255 -0.903 . . . . 0.0 110.739 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.4 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 2.6 m80 -96.69 -172.36 2.47 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 178.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.876 HG22 ' CE1' ' A' ' 93' ' ' HIS . 39.8 mm -84.74 -37.14 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.292 0 O-C-N 120.998 -1.064 . . . . 0.0 109.275 178.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.45 -27.26 20.49 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.74 -1.225 . . . . 0.0 111.213 179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 83.3 m -70.46 -46.49 63.7 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 120.819 -1.176 . . . . 0.0 110.435 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.413 ' HG2' HD12 ' A' ' 32' ' ' ILE . 9.7 tpt -68.8 -38.52 80.0 Favored 'General case' 0 N--CA 1.506 2.373 0 C-N-CA 119.403 -0.919 . . . . 0.0 110.323 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.455 ' CE1' HG13 ' A' ' 94' ' ' ILE . 9.3 m-85 -75.05 -31.43 61.3 Favored 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 118.803 -1.159 . . . . 0.0 109.578 179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -62.51 -36.21 81.82 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 121.026 -1.047 . . . . 0.0 109.524 178.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.0 tttt -60.24 -40.16 89.28 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.093 -1.005 . . . . 0.0 109.758 179.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.781 ' HB3' HD21 ' A' ' 97' ' ' LEU . 10.1 mp -60.96 -42.33 98.08 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.975 . . . . 0.0 109.154 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.4 ' N ' HD11 ' A' ' 97' ' ' LEU . 6.9 tt0 -56.08 -33.68 65.27 Favored 'General case' 0 N--CA 1.509 2.502 0 O-C-N 121.205 -0.935 . . . . 0.0 109.674 178.635 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 33.4 mtm-85 -102.63 29.59 5.21 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.279 -0.888 . . . . 0.0 110.449 178.931 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.14 169.41 8.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.905 -1.122 . . . . 0.0 109.902 179.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.96 146.77 25.36 Favored 'General case' 0 N--CA 1.505 2.286 0 O-C-N 121.184 -0.948 . . . . 0.0 110.177 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.14 -34.1 71.67 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 121.187 -0.946 . . . . 0.0 110.7 -179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.64 -35.72 31.95 Favored 'General case' 0 N--CA 1.514 2.746 0 O-C-N 121.028 -1.045 . . . . 0.0 111.075 -179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 29.7 m -113.57 121.57 44.62 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.069 -1.019 . . . . 0.0 110.285 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.4 ttmm -118.15 144.52 45.63 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.192 -0.942 . . . . 0.0 110.176 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.402 ' O ' HD21 ' A' ' 60' ' ' LEU . 13.3 mtmt -124.58 139.4 53.91 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.129 -0.982 . . . . 0.0 110.402 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.2 mt 54.77 101.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.2 -0.937 . . . . 0.0 110.821 179.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -110.92 143.32 41.73 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.068 -1.02 . . . . 0.0 109.892 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.58 -170.75 0.05 OUTLIER 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.039 -1.038 . . . . 0.0 110.477 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.709 HD21 ' CG ' ' A' ' 87' ' ' LYS . 2.8 tp -111.37 43.4 1.5 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.146 -0.971 . . . . 0.0 110.105 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -150.9 -168.9 3.24 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.141 -0.974 . . . . 0.0 110.051 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 16.8 mt-10 55.42 38.11 29.83 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.905 -1.122 . . . . 0.0 109.935 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.822 HD11 ' HB3' ' A' ' 6' ' ' PHE . 1.5 tp -144.65 150.44 37.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.348 -0.845 . . . . 0.0 109.48 -179.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -93.78 104.45 16.53 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.061 -1.024 . . . . 0.0 110.464 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.412 ' HA3' HG22 ' A' ' 8' ' ' VAL . . . 150.02 -45.26 0.68 Allowed Glycine 0 N--CA 1.494 2.514 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.762 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 34.0 p-90 -58.72 -35.51 72.79 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.004 -1.292 . . . . 0.0 110.614 -179.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -56.17 -34.4 66.14 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 120.921 -1.112 . . . . 0.0 110.699 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -83.58 -34.87 25.08 Favored 'General case' 0 N--CA 1.507 2.404 0 O-C-N 120.953 -1.092 . . . . 0.0 110.722 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.651 ' CD2' HD11 ' A' ' 90' ' ' ILE . 0.2 OUTLIER -49.77 175.1 0.01 OUTLIER 'General case' 0 N--CA 1.518 2.93 0 O-C-N 121.067 -1.02 . . . . 0.0 110.941 -179.682 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -101.76 161.61 13.53 Favored 'General case' 0 N--CA 1.5 2.047 0 O-C-N 121.199 -0.938 . . . . 0.0 110.312 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -58.59 -45.3 89.41 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.139 -0.976 . . . . 0.0 110.41 -179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.0 t-20 -61.52 -51.75 67.32 Favored 'General case' 0 N--CA 1.509 2.503 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.533 179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -63.65 -39.33 94.09 Favored 'General case' 0 N--CA 1.506 2.339 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.111 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.763 ' HA ' HD12 ' A' ' 90' ' ' ILE . 19.9 ttpp -59.96 -38.75 83.39 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.305 -0.872 . . . . 0.0 109.709 179.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -60.32 -39.35 86.73 Favored 'General case' 0 N--CA 1.508 2.457 0 O-C-N 121.15 -0.969 . . . . 0.0 109.861 179.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -59.84 -40.95 90.25 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.14 -0.975 . . . . 0.0 110.1 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.763 HD12 ' HA ' ' A' ' 87' ' ' LYS . 10.4 mt -62.28 -40.19 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.41 0 O-C-N 121.205 -0.934 . . . . 0.0 109.524 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.9 m -58.15 -39.62 79.25 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.04 -1.037 . . . . 0.0 109.921 179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -58.8 -39.27 80.65 Favored 'General case' 0 N--CA 1.509 2.479 0 O-C-N 121.227 -0.92 . . . . 0.0 109.627 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.876 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.3 m-70 -60.01 -52.04 67.08 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.253 -0.904 . . . . 0.0 109.778 179.644 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.455 HG13 ' CE1' ' A' ' 57' ' ' PHE . 11.6 mt -62.68 -39.08 83.37 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.372 0 C-N-CA 119.383 -0.927 . . . . 0.0 109.444 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.4 -39.72 94.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.187 -0.946 . . . . 0.0 109.47 179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -72.7 -39.7 66.78 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.229 -0.919 . . . . 0.0 109.11 178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.781 HD21 ' HB3' ' A' ' 60' ' ' LEU . 21.6 tp -68.5 -32.58 72.66 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.267 -0.896 . . . . 0.0 110.363 179.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 16.3 t -92.81 -40.63 10.55 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 120.925 -1.109 . . . . 0.0 110.177 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.6 t -128.23 166.56 18.33 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.143 -0.973 . . . . 0.0 110.147 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 35.1 tttm -138.88 110.2 6.94 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.207 -0.933 . . . . 0.0 110.306 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -119.41 161.34 20.68 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.193 -0.942 . . . . 0.0 110.233 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -138.46 144.65 40.19 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.238 -0.914 . . . . 0.0 110.28 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -128.05 -159.17 9.96 Favored Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.512 -1.435 . . . . 0.0 109.512 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.5 p -125.17 149.2 63.04 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.173 -1.193 . . . . 0.0 110.252 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.72 -43.21 0.93 Allowed 'Trans proline' 0 C--N 1.317 -1.097 0 O-C-N 123.42 1.221 . . . . 0.0 110.415 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt -140.21 170.76 15.22 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.17 -0.956 . . . . 0.0 110.232 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -117.52 -63.67 1.4 Allowed 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.251 -0.906 . . . . 0.0 110.271 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 23.8 mttm -117.19 73.45 0.87 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.199 -0.938 . . . . 0.0 110.204 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -119.6 167.49 11.95 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.179 -0.951 . . . . 0.0 110.123 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.6 t -114.21 132.78 62.28 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 O-C-N 121.217 -0.927 . . . . 0.0 109.991 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.4 p -136.01 143.29 36.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.196 -0.94 . . . . 0.0 110.151 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -118.73 126.96 53.06 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.261 -0.9 . . . . 0.0 110.244 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.62 101.5 8.41 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.158 -0.964 . . . . 0.0 110.137 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 75.4 tttt -117.19 137.23 52.48 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.169 -0.957 . . . . 0.0 110.248 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -119.91 153.5 35.79 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.217 -0.927 . . . . 0.0 110.17 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -115.33 136.05 53.5 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.206 -0.934 . . . . 0.0 110.215 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.304 -179.986 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 ttt . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -143.53 92.11 2.33 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.16 -0.962 . . . . 0.0 110.274 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -127.19 126.93 43.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.212 -0.93 . . . . 0.0 110.212 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 57.89 164.04 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.254 -0.904 . . . . 0.0 110.491 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -124.01 129.98 51.82 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.147 -0.971 . . . . 0.0 110.167 -179.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.412 ' CE1' ' HB2' ' A' ' 34' ' ' LYS . 1.4 m-85 -124.02 137.44 54.59 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.158 -0.964 . . . . 0.0 110.086 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.2 t -126.77 147.87 49.96 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 109.628 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.888 ' CG1' HD23 ' A' ' 76' ' ' LEU . 27.2 m -116.18 139.63 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 121.057 -1.027 . . . . 0.0 110.604 179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -147.5 162.73 38.47 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.24 -0.913 . . . . 0.0 110.399 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.706 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.6 OUTLIER -110.29 141.55 43.12 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 121.368 -0.832 . . . . 0.0 109.814 179.891 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.439 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -63.93 134.06 54.4 Favored 'General case' 0 N--CA 1.507 2.396 0 C-N-CA 119.185 -1.006 . . . . 0.0 109.744 -179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 13.0 mmtp -140.62 -65.68 0.45 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.209 -0.932 . . . . 0.0 110.465 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.1 mtp85 -121.97 85.33 2.39 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.176 -0.953 . . . . 0.0 110.228 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 126.92 159.36 10.16 Favored Glycine 0 N--CA 1.494 2.53 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -132.48 149.64 52.3 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.212 -1.169 . . . . 0.0 110.086 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.06 145.85 50.58 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.168 -0.958 . . . . 0.0 110.557 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.43 118.63 7.97 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 19.9 t -63.85 123.28 18.52 Favored 'General case' 0 N--CA 1.509 2.483 0 O-C-N 121.191 -1.182 . . . . 0.0 109.695 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.417 ' HB2' ' CE2' ' A' ' 51' ' ' TYR . 0.8 OUTLIER -61.61 147.86 44.33 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.08 -1.013 . . . . 0.0 108.664 179.176 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.5 mmtt 53.09 64.66 1.78 Allowed 'General case' 0 N--CA 1.507 2.386 0 O-C-N 120.979 -1.076 . . . . 0.0 108.815 -178.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 41.9 t -173.04 -43.58 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.249 -0.907 . . . . 0.0 112.583 -177.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 4.1 ttmt 69.06 44.15 1.04 Allowed 'General case' 0 N--CA 1.505 2.295 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 -177.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.73 -168.71 2.91 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.564 -0.71 . . . . 0.0 109.437 -179.122 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -140.1 158.67 43.69 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.017 -1.052 . . . . 0.0 110.193 -179.439 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.644 HG23 ' CG2' ' A' ' 29' ' ' VAL . 50.8 mt -102.89 118.12 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.505 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 60.3 t -107.76 160.25 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.162 -0.961 . . . . 0.0 110.352 -179.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -48.49 121.7 4.74 Favored 'General case' 0 N--CA 1.513 2.688 0 O-C-N 121.444 -0.785 . . . . 0.0 111.15 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 126.68 -25.93 5.24 Favored Glycine 0 N--CA 1.493 2.448 0 C-N-CA 119.999 -1.096 . . . . 0.0 110.912 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.644 ' CG2' HG23 ' A' ' 25' ' ' ILE . 6.6 m -104.38 137.61 32.62 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.116 0 CA-C-N 119.148 1.474 . . . . 0.0 110.488 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.919 ' HB3' HD11 ' A' ' 53' ' ' ILE . 1.3 t -81.06 134.99 35.76 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.192 -0.942 . . . . 0.0 109.647 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.432 ' CB ' HD13 ' A' ' 25' ' ' ILE . 12.0 ptt-85 -122.43 149.03 44.39 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.201 -0.937 . . . . 0.0 110.402 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 13.1 mt -108.35 139.87 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.957 0 O-C-N 121.315 -0.865 . . . . 0.0 110.603 -179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.03 122.38 6.9 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 108.598 -1.801 . . . . 0.0 108.598 178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 41.0 tttt -105.97 120.07 40.83 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.101 -1.235 . . . . 0.0 110.082 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.429 HG12 ' CB ' ' A' ' 46' ' ' ASP . 62.1 t -103.5 107.17 21.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.25 -0.906 . . . . 0.0 110.22 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.7 t -122.31 138.31 28.89 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 109.615 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -73.92 131.89 16.24 Favored 'Trans proline' 0 C--N 1.318 -1.075 0 O-C-N 123.262 1.138 . . . . 0.0 110.22 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.2 m-80 -103.19 154.31 37.76 Favored Pre-proline 0 N--CA 1.499 1.999 0 O-C-N 121.102 -0.999 . . . . 0.0 110.166 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -72.45 -40.25 2.32 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 O-C-N 123.43 1.226 . . . . 0.0 110.306 179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -115.13 107.31 15.15 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.224 -0.922 . . . . 0.0 110.07 179.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.53 157.0 42.41 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.189 -0.945 . . . . 0.0 110.364 -179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -95.98 -39.34 9.82 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.241 -0.912 . . . . 0.0 110.401 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 t -87.76 -40.06 14.4 Favored 'General case' 0 N--CA 1.505 2.309 0 O-C-N 121.006 -1.059 . . . . 0.0 110.005 179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 106.28 112.56 3.7 Favored Glycine 0 N--CA 1.493 2.485 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 140.85 -148.5 20.14 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.429 ' CB ' HG12 ' A' ' 35' ' ' VAL . 0.9 OUTLIER -116.74 158.09 24.43 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.166 -1.196 . . . . 0.0 110.245 -179.889 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.7 ttt -101.72 144.16 30.76 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.363 -0.836 . . . . 0.0 110.119 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.417 ' HE3' ' CZ2' ' A' ' 50' ' ' TRP . 26.9 ttpt -116.53 123.01 46.37 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.327 -0.858 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -115.26 140.36 49.17 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.346 -0.846 . . . . 0.0 109.712 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.452 ' CZ3' ' N ' ' A' ' 33' ' ' GLY . 57.0 m95 -97.83 128.14 44.26 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.137 -0.977 . . . . 0.0 110.167 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.417 ' CE2' ' HB2' ' A' ' 19' ' ' LYS . 97.4 m-85 -115.81 174.64 5.92 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.344 -0.847 . . . . 0.0 110.855 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.404 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 8.8 m80 -91.28 -171.43 2.95 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.98 HG22 ' CE1' ' A' ' 93' ' ' HIS . 46.6 mm -83.49 -39.9 15.55 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 O-C-N 120.879 -1.138 . . . . 0.0 109.722 179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.8 mmtt -85.06 -32.26 22.96 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 120.83 -1.169 . . . . 0.0 111.058 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.404 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 71.2 m -62.68 -52.89 61.51 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 120.994 -1.066 . . . . 0.0 110.4 -179.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -40.39 88.02 Favored 'General case' 0 N--CA 1.506 2.365 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.012 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.673 ' HB2' ' HE2' ' A' ' 93' ' ' HIS . 9.6 m-85 -70.97 -30.43 66.7 Favored 'General case' 0 N--CA 1.504 2.232 0 C-N-CA 119.08 -1.048 . . . . 0.0 109.634 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -61.35 -36.86 81.35 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.598 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 -41.14 88.58 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.024 -1.048 . . . . 0.0 109.804 179.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 69' ' ' LYS . 10.2 mp -63.05 -44.42 95.92 Favored 'General case' 0 N--CA 1.507 2.379 0 C-N-CA 119.429 -0.909 . . . . 0.0 108.969 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -57.38 -33.62 68.01 Favored 'General case' 0 N--CA 1.508 2.429 0 O-C-N 121.218 -0.926 . . . . 0.0 109.695 178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -103.65 29.33 5.82 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.277 -0.889 . . . . 0.0 110.576 179.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -116.87 166.89 11.63 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.888 -1.133 . . . . 0.0 110.042 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.3 tpp180 -64.78 155.98 32.1 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.209 -0.932 . . . . 0.0 109.904 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -82.79 -33.36 27.3 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.216 -0.927 . . . . 0.0 110.764 179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 16.6 p -50.26 -35.52 27.35 Favored 'General case' 0 N--CA 1.515 2.825 0 O-C-N 120.987 -1.07 . . . . 0.0 110.947 -179.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 77.2 p -110.06 124.47 51.53 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.096 -1.002 . . . . 0.0 109.888 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 19.5 ttmt -116.27 144.58 44.04 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.254 -0.904 . . . . 0.0 110.369 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.536 ' O ' HD21 ' A' ' 60' ' ' LEU . 17.2 mtpp -122.51 146.82 47.05 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.264 -0.898 . . . . 0.0 110.103 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 77.4 mt 54.54 99.34 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.213 -0.929 . . . . 0.0 110.704 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 42.6 tt0 -112.7 135.25 53.66 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.162 -0.961 . . . . 0.0 109.978 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 53.0 -173.52 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.039 -1.038 . . . . 0.0 110.547 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.697 ' O ' HG23 ' A' ' 74' ' ' THR . 49.8 tp -113.71 83.26 1.82 Allowed 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.162 -0.961 . . . . 0.0 110.22 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.697 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -170.0 -51.62 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.168 0 O-C-N 121.161 -0.962 . . . . 0.0 111.056 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -49.38 -36.32 21.43 Favored 'General case' 0 N--CA 1.515 2.817 0 O-C-N 121.113 -0.992 . . . . 0.0 110.796 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.888 HD23 ' CG1' ' A' ' 8' ' ' VAL . 6.3 mp -72.74 150.43 42.87 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.189 -0.944 . . . . 0.0 109.367 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.524 ' O ' HG22 ' A' ' 8' ' ' VAL . 12.9 mm-40 -97.77 136.74 37.68 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.249 -0.907 . . . . 0.0 111.251 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 129.53 -41.63 1.52 Allowed Glycine 0 N--CA 1.492 2.432 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.46 ' CD2' ' N ' ' A' ' 80' ' ' GLU . 52.9 p-90 -53.96 -35.65 62.01 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 120.993 -1.298 . . . . 0.0 110.868 -179.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.46 ' N ' ' CD2' ' A' ' 79' ' ' TRP . 15.8 tt0 -68.11 -28.93 67.76 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.111 -0.993 . . . . 0.0 111.035 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -96.38 -34.52 11.51 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 120.826 -1.171 . . . . 0.0 111.251 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.706 HD13 ' CD2' ' A' ' 10' ' ' TYR . 74.4 mt -59.25 -175.3 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 O-C-N 120.865 -1.147 . . . . 0.0 110.151 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.33 161.63 11.21 Favored 'General case' 0 N--CA 1.508 2.455 0 O-C-N 121.154 -0.966 . . . . 0.0 110.26 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.2 -45.43 11.33 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.217 -0.927 . . . . 0.0 109.925 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -62.6 -42.45 99.58 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.315 -0.866 . . . . 0.0 109.396 179.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.422 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 1.1 mp0 -61.57 -40.28 94.16 Favored 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.338 -0.851 . . . . 0.0 109.514 179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.521 ' CG ' HD21 ' A' ' 73' ' ' LEU . 22.2 ttpt -57.66 -39.57 77.33 Favored 'General case' 0 N--CA 1.509 2.516 0 O-C-N 121.322 -0.861 . . . . 0.0 109.943 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -60.41 -42.23 95.53 Favored 'General case' 0 N--CA 1.508 2.441 0 O-C-N 121.206 -0.933 . . . . 0.0 109.637 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 -59.81 -35.37 74.56 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.324 -0.86 . . . . 0.0 110.237 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.568 ' CG2' HD13 ' A' ' 73' ' ' LEU . 37.9 mm -60.33 -38.93 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.492 0 O-C-N 121.109 -0.994 . . . . 0.0 109.634 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 1.1 m -58.59 -42.53 88.29 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.02 -1.05 . . . . 0.0 109.795 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -63.35 -40.64 97.84 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.297 -0.877 . . . . 0.0 109.284 179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.98 ' CE1' HG22 ' A' ' 53' ' ' ILE . 67.6 t60 -58.39 -41.8 85.7 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.192 -0.942 . . . . 0.0 109.59 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.441 ' CG1' ' CZ ' ' A' ' 57' ' ' PHE . 9.3 mt -69.75 -39.62 78.18 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.369 0 O-C-N 121.176 -0.952 . . . . 0.0 108.9 178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.89 -38.05 84.32 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.211 -0.931 . . . . 0.0 109.728 179.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -63.62 -41.48 98.27 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.134 -0.978 . . . . 0.0 109.488 179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.446 HD21 ' HB3' ' A' ' 60' ' ' LEU . 5.9 tp -60.7 -35.58 76.66 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.243 -0.911 . . . . 0.0 110.33 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 15.1 t -89.93 -39.29 13.1 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.05 -1.031 . . . . 0.0 110.178 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 41.8 t -114.51 106.53 14.38 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.183 -0.948 . . . . 0.0 110.099 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.8 tttp -116.35 135.64 53.69 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.167 -0.958 . . . . 0.0 110.27 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -131.66 77.6 1.78 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.183 -0.948 . . . . 0.0 110.131 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -142.44 124.56 15.39 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.168 -0.958 . . . . 0.0 110.3 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -137.5 46.05 1.03 Allowed Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.504 -1.439 . . . . 0.0 109.504 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 25.3 m -138.89 56.71 9.74 Favored Pre-proline 0 N--CA 1.494 1.745 0 O-C-N 121.183 -1.187 . . . . 0.0 110.176 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.52 129.36 14.62 Favored 'Trans proline' 0 C--N 1.317 -1.1 0 O-C-N 123.287 1.151 . . . . 0.0 110.338 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -144.42 139.1 28.18 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.203 -0.936 . . . . 0.0 110.299 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt -135.81 -65.07 0.6 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.192 -0.943 . . . . 0.0 110.198 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.1 tttm -144.73 -58.82 0.36 Allowed 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.179 -0.95 . . . . 0.0 110.47 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -134.29 110.11 9.28 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.168 -0.958 . . . . 0.0 110.204 179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.7 t -118.29 100.12 9.38 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 O-C-N 121.241 -0.912 . . . . 0.0 109.889 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.1 t -138.11 143.1 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 O-C-N 121.269 -0.894 . . . . 0.0 110.0 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -117.15 138.88 51.37 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.091 -1.006 . . . . 0.0 110.231 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.26 127.82 54.09 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.21 -0.931 . . . . 0.0 110.234 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 20.1 mtmm -121.27 105.66 10.76 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.167 -0.958 . . . . 0.0 110.185 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 91.7 mt -120.33 103.67 9.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.206 -0.934 . . . . 0.0 110.206 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.0 p -136.7 118.6 15.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.228 -0.92 . . . . 0.0 110.125 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 73.3 m . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 117.944 -1.026 . . . . 0.0 110.141 -179.995 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 ttt . . . . . 0 N--CA 1.492 1.663 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.562 ' HB3' ' CG ' ' A' ' 37' ' ' PRO . . . -143.38 -59.68 0.41 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.171 -0.955 . . . . 0.0 110.253 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -128.56 166.09 19.51 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.283 -0.886 . . . . 0.0 110.144 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -118.58 130.22 55.77 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 110.231 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -141.47 125.43 17.17 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.237 -0.915 . . . . 0.0 110.288 -179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.443 ' CZ ' ' CD ' ' A' ' 34' ' ' LYS . 0.9 OUTLIER -117.05 141.56 48.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.17 -0.956 . . . . 0.0 110.052 179.848 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' O ' HG23 ' A' ' 32' ' ' ILE . 80.5 m -127.74 156.39 42.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 109.803 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.415 HG23 ' HB3' ' A' ' 76' ' ' LEU . 59.6 t -111.2 120.58 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.976 0 O-C-N 121.128 -0.982 . . . . 0.0 109.927 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -137.95 156.45 47.85 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.136 -0.978 . . . . 0.0 110.605 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.411 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -101.45 154.1 19.11 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.485 -0.76 . . . . 0.0 109.693 179.609 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.27 140.76 29.38 Favored 'General case' 0 N--CA 1.504 2.228 0 O-C-N 121.246 -0.909 . . . . 0.0 110.34 -179.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 7.1 tttp -136.03 -58.11 0.76 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.279 -0.888 . . . . 0.0 110.456 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.6 mmm180 -134.34 99.14 4.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.98 -1.075 . . . . 0.0 110.316 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 144.6 138.65 3.35 Favored Glycine 0 N--CA 1.495 2.627 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 26' ' ' VAL . 76.6 p -124.54 146.35 49.06 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.189 -1.183 . . . . 0.0 109.942 179.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -163.35 153.93 16.16 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.18 -0.95 . . . . 0.0 111.435 -179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -70.77 120.13 8.66 Favored Glycine 0 N--CA 1.489 2.213 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.475 ' SG ' ' HB3' ' A' ' 21' ' ' CYS . 24.5 p -58.92 140.29 55.64 Favored 'General case' 0 N--CA 1.51 2.567 0 O-C-N 121.184 -1.186 . . . . 0.0 110.21 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.404 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 8.0 tptt -94.19 150.73 20.04 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 121.114 -0.991 . . . . 0.0 110.581 -178.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 13.2 mptt 51.6 48.39 22.97 Favored 'General case' 0 N--CA 1.51 2.557 0 N-CA-C 107.556 -1.276 . . . . 0.0 107.556 -178.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.475 ' HB3' ' SG ' ' A' ' 18' ' ' CYS 0.263 10.4 t -165.2 -44.41 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.861 -0.524 . . . . 0.0 110.485 -175.481 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 21' ' ' CYS . 23.5 tttt 78.12 74.22 0.06 Allowed 'General case' 0 N--CA 1.526 3.342 0 O-C-N 120.947 -1.096 . . . . 0.0 112.492 177.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.419 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.4 tt0 -176.11 -172.88 0.53 Allowed 'General case' 0 N--CA 1.508 2.47 0 O-C-N 121.165 -0.959 . . . . 0.0 110.604 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -120.3 146.16 46.38 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.112 -0.992 . . . . 0.0 109.142 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.9 mt -107.11 141.82 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 O-C-N 121.058 -1.026 . . . . 0.0 110.477 -179.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.555 ' HA ' HG22 ' A' ' 15' ' ' THR . 59.4 t -141.12 158.04 22.68 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.249 -0.907 . . . . 0.0 109.961 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.54 135.97 17.43 Favored 'General case' 0 N--CA 1.516 2.83 0 O-C-N 121.287 -0.883 . . . . 0.0 111.089 -179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.56 8.72 39.81 Favored Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.155 -1.021 . . . . 0.0 111.828 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.437 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.8 p -127.45 132.79 69.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 CA-C-N 119.853 1.827 . . . . 0.0 110.855 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.411 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 20.2 t -73.19 143.3 47.25 Favored 'General case' 0 N--CA 1.507 2.389 0 O-C-N 121.22 -0.925 . . . . 0.0 108.855 178.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.428 ' HD2' ' CG ' ' A' ' 50' ' ' TRP . 11.9 ptt180 -145.47 155.38 43.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.123 -0.986 . . . . 0.0 111.475 -179.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.527 HG23 ' O ' ' A' ' 7' ' ' CYS . 3.8 mt -105.08 145.09 13.85 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 O-C-N 121.449 -0.782 . . . . 0.0 109.848 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.83 137.69 13.91 Favored Glycine 0 N--CA 1.493 2.471 0 N-CA-C 108.413 -1.875 . . . . 0.0 108.413 179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.443 ' CD ' ' CZ ' ' A' ' 6' ' ' PHE . 19.4 ttpt -117.94 123.75 46.55 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.903 -1.351 . . . . 0.0 110.42 -179.526 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -96.44 113.09 29.95 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.229 -0.919 . . . . 0.0 110.115 179.808 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.9 t -120.49 119.13 30.6 Favored Pre-proline 0 N--CA 1.495 1.816 0 O-C-N 121.267 -0.896 . . . . 0.0 109.916 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.562 ' CG ' ' HB3' ' A' ' 2' ' ' ALA . 47.6 Cg_endo -73.35 145.66 38.73 Favored 'Trans proline' 0 C--N 1.32 -0.961 0 O-C-N 123.132 1.07 . . . . 0.0 110.342 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -102.88 146.93 33.31 Favored Pre-proline 0 N--CA 1.5 2.039 0 O-C-N 121.149 -0.97 . . . . 0.0 110.151 179.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.62 70.25 4.2 Favored 'Trans proline' 0 C--N 1.318 -1.039 0 O-C-N 123.328 1.173 . . . . 0.0 110.46 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 39.3 t80 -153.55 -58.88 0.13 Allowed 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.09 -1.006 . . . . 0.0 110.499 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.3 t -121.26 144.6 48.53 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.245 -0.91 . . . . 0.0 110.157 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -99.39 -22.16 15.68 Favored 'General case' 0 N--CA 1.503 2.175 0 O-C-N 121.195 -0.94 . . . . 0.0 111.886 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.2 m -88.77 -40.6 13.09 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 120.615 -1.303 . . . . 0.0 110.074 179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -130.0 66.76 0.57 Allowed Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -136.9 75.98 0.38 Allowed Glycine 0 N--CA 1.493 2.436 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -144.22 136.61 26.66 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.147 -1.207 . . . . 0.0 110.268 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.3 ttt -117.04 142.95 46.31 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.275 -0.891 . . . . 0.0 110.34 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.4 ttmt -125.25 120.74 32.09 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.278 -0.889 . . . . 0.0 110.26 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 73.5 mm-40 -117.98 149.46 40.9 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.254 -0.904 . . . . 0.0 109.221 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.428 ' CG ' ' HD2' ' A' ' 31' ' ' ARG . 16.9 m95 -91.62 163.2 14.2 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.148 -0.97 . . . . 0.0 110.105 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.447 ' OH ' ' HB2' ' A' ' 20' ' ' LYS . 34.0 m-85 -140.39 173.91 11.04 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.38 -0.825 . . . . 0.0 110.841 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.439 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 11.1 m80 -108.77 -176.92 3.17 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.361 -0.837 . . . . 0.0 109.52 177.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 1.009 HG22 ' CE1' ' A' ' 93' ' ' HIS . 48.7 mm -97.48 -60.45 2.68 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.147 -0.971 . . . . 0.0 109.624 178.123 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -80.1 -43.14 22.25 Favored 'General case' 0 N--CA 1.508 2.445 0 O-C-N 120.782 -1.199 . . . . 0.0 109.388 179.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.439 ' HB3' ' CB ' ' A' ' 52' ' ' HIS . 19.3 t -63.12 -27.99 69.76 Favored 'General case' 0 N--CA 1.507 2.386 0 C-N-CA 119.622 -0.831 . . . . 0.0 109.71 178.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -83.2 -54.34 5.09 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 120.725 -1.234 . . . . 0.0 108.648 177.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.576 ' HD2' HD22 ' A' ' 97' ' ' LEU . 13.0 m-85 -59.61 -26.55 65.56 Favored 'General case' 0 N--CA 1.503 2.219 0 C-N-CA 119.262 -0.975 . . . . 0.0 109.72 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -60.71 -38.98 86.89 Favored 'General case' 0 N--CA 1.506 2.352 0 O-C-N 120.833 -1.167 . . . . 0.0 109.375 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.5 tttm -67.96 -40.65 83.17 Favored 'General case' 0 N--CA 1.507 2.411 0 C-N-CA 119.242 -0.983 . . . . 0.0 109.281 178.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 mp -60.75 -41.76 96.06 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.239 -0.913 . . . . 0.0 109.081 179.031 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.525 ' HB2' HD11 ' A' ' 97' ' ' LEU . 8.4 tt0 -56.17 -33.41 65.22 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.245 -0.909 . . . . 0.0 109.695 178.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.3 mtp-105 -103.68 29.87 5.46 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.316 -0.865 . . . . 0.0 110.573 179.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -113.17 168.42 9.73 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.948 -1.095 . . . . 0.0 110.026 179.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 -63.18 154.76 30.22 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 121.173 -0.954 . . . . 0.0 110.137 -179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.97 -33.92 19.46 Favored 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.168 -0.957 . . . . 0.0 110.751 179.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -49.46 -32.88 12.86 Favored 'General case' 0 N--CA 1.515 2.805 0 O-C-N 120.882 -1.136 . . . . 0.0 111.344 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 35.6 m -104.07 120.06 40.27 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 120.924 -1.11 . . . . 0.0 110.069 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 6.3 mmtt -116.82 144.34 44.61 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.202 -0.936 . . . . 0.0 110.267 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 9.7 mtpt -138.35 154.32 48.96 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.243 -0.91 . . . . 0.0 110.183 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.3 97.67 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.095 0 O-C-N 121.174 -0.953 . . . . 0.0 110.642 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -114.79 136.2 53.34 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.147 -0.97 . . . . 0.0 110.333 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 52.67 -178.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.043 -1.036 . . . . 0.0 110.919 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.787 HD13 ' CG2' ' A' ' 90' ' ' ILE . 62.3 tp -114.4 81.22 1.51 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.291 -0.881 . . . . 0.0 110.374 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.507 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -172.17 -51.63 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.145 -0.972 . . . . 0.0 110.722 179.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -51.19 -36.77 43.0 Favored 'General case' 0 N--CA 1.513 2.715 0 O-C-N 121.11 -0.994 . . . . 0.0 110.425 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' A' ' 6' ' ' PHE . 1.4 mp -63.46 152.33 38.68 Favored 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.136 -0.978 . . . . 0.0 109.451 179.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -102.1 116.29 32.36 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.187 -0.946 . . . . 0.0 110.307 -179.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 141.08 -36.12 1.77 Allowed Glycine 0 N--CA 1.492 2.408 0 C-N-CA 119.909 -1.139 . . . . 0.0 110.467 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -51.53 -32.24 27.12 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.894 -1.357 . . . . 0.0 111.021 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 10.3 tm-20 -56.7 -39.87 74.63 Favored 'General case' 0 N--CA 1.511 2.612 0 O-C-N 120.907 -1.121 . . . . 0.0 110.126 179.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -65.61 -41.16 93.04 Favored 'General case' 0 N--CA 1.51 2.537 0 O-C-N 121.169 -0.957 . . . . 0.0 109.629 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.61 ' CD2' HD11 ' A' ' 90' ' ' ILE . 3.8 mp -47.67 165.55 0.03 OUTLIER 'General case' 0 N--CA 1.517 2.913 0 O-C-N 121.291 -0.881 . . . . 0.0 110.875 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -88.47 161.37 17.05 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.226 -0.921 . . . . 0.0 109.823 179.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -56.32 -38.27 71.09 Favored 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.15 -0.968 . . . . 0.0 110.687 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 10.1 m-80 -71.89 -40.42 68.91 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.182 -0.949 . . . . 0.0 109.707 179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -73.4 -36.16 65.97 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.222 -0.924 . . . . 0.0 109.346 178.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.495 ' HG2' HD21 ' A' ' 73' ' ' LEU . 12.7 tttm -69.56 -37.67 77.12 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.117 -0.989 . . . . 0.0 109.625 178.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -64.55 -39.49 93.85 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.211 -0.931 . . . . 0.0 109.667 179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -59.82 -34.03 72.53 Favored 'General case' 0 N--CA 1.509 2.488 0 O-C-N 121.172 -0.955 . . . . 0.0 110.578 179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.787 ' CG2' HD13 ' A' ' 73' ' ' LEU . 96.5 mt -65.01 -39.92 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.484 0 O-C-N 121.02 -1.05 . . . . 0.0 109.571 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.52 HG23 ' CD2' ' A' ' 73' ' ' LEU . 73.8 p -61.82 -46.76 88.09 Favored 'General case' 0 N--CA 1.509 2.487 0 O-C-N 121.063 -1.023 . . . . 0.0 109.354 179.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -61.66 -38.96 89.69 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.267 -0.896 . . . . 0.0 108.897 178.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 1.009 ' CE1' HG22 ' A' ' 53' ' ' ILE . 42.1 t60 -57.22 -48.82 77.83 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.238 -0.914 . . . . 0.0 109.737 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 8.0 mt -69.49 -39.97 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.309 0 C-N-CA 119.3 -0.96 . . . . 0.0 108.648 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.73 -35.98 81.51 Favored 'General case' 0 N--CA 1.506 2.364 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.683 178.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -66.31 -37.6 85.78 Favored 'General case' 0 N--CA 1.508 2.453 0 O-C-N 121.127 -0.983 . . . . 0.0 110.072 179.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.576 HD22 ' HD2' ' A' ' 57' ' ' PHE . 4.3 tp -74.93 -40.52 60.78 Favored 'General case' 0 N--CA 1.507 2.388 0 O-C-N 121.114 -0.991 . . . . 0.0 110.032 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.0 t -60.99 -44.0 98.04 Favored 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.219 -0.926 . . . . 0.0 109.882 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 8.4 t -144.12 116.54 8.56 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.252 -0.905 . . . . 0.0 110.272 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 29.0 tttt -116.73 -57.36 2.19 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.22 -0.925 . . . . 0.0 110.269 -179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.42 -178.27 4.17 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.159 -0.963 . . . . 0.0 110.236 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -136.06 53.24 1.95 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.261 -0.899 . . . . 0.0 110.195 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -73.5 -165.18 10.07 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.7 m -135.39 116.85 12.11 Favored Pre-proline 0 N--CA 1.494 1.775 0 O-C-N 121.21 -1.17 . . . . 0.0 110.133 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.15 156.08 55.92 Favored 'Trans proline' 0 N--CA 1.486 1.038 0 O-C-N 123.144 1.076 . . . . 0.0 110.427 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 4.1 mttp -118.18 -57.59 2.07 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.275 -0.891 . . . . 0.0 110.121 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 16.1 mmmt -117.34 129.27 55.77 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.168 -0.958 . . . . 0.0 110.132 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.8 mtpt -117.33 -57.17 2.17 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.182 -0.949 . . . . 0.0 110.189 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.87 165.2 13.59 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.183 -0.948 . . . . 0.0 110.143 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 9.1 p -130.48 147.99 33.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.194 -0.941 . . . . 0.0 110.3 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.7 t -116.4 143.09 27.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.204 -0.935 . . . . 0.0 109.941 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -117.27 128.22 54.86 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.156 -0.965 . . . . 0.0 110.185 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -135.15 141.33 45.92 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.173 -0.954 . . . . 0.0 110.212 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -116.72 98.9 6.77 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.234 -0.916 . . . . 0.0 110.279 179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.49 125.57 52.13 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.143 -0.973 . . . . 0.0 110.061 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 43.1 p -118.45 149.28 41.53 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.139 -0.975 . . . . 0.0 110.187 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.261 179.924 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.3 mtm . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 120.729 0.3 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -117.38 46.81 1.63 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.168 -0.958 . . . . 0.0 110.174 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -116.32 -56.29 2.31 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.237 -0.915 . . . . 0.0 110.254 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -138.62 134.55 33.88 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.19 -0.944 . . . . 0.0 110.348 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 14.7 mtp180 -136.73 149.67 47.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.153 -0.967 . . . . 0.0 110.143 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.874 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -120.55 149.82 41.83 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.268 -0.895 . . . . 0.0 110.472 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.0 t -136.96 126.02 24.44 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.251 -0.906 . . . . 0.0 109.666 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.767 HG12 HG23 ' A' ' 32' ' ' ILE . 20.0 m -102.79 106.21 19.59 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.196 0 O-C-N 121.143 -0.973 . . . . 0.0 110.671 -179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -118.26 158.95 24.21 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.917 -1.115 . . . . 0.0 110.476 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CD2' HD11 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -101.69 144.4 30.45 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.49 -0.756 . . . . 0.0 109.819 179.797 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -59.95 102.04 0.14 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.245 -0.91 . . . . 0.0 109.879 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -123.42 110.81 15.59 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.28 -0.888 . . . . 0.0 110.167 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 8.9 mtt-85 52.94 88.51 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.06 -1.025 . . . . 0.0 110.708 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.16 131.36 2.76 Favored Glycine 0 N--CA 1.494 2.551 0 N-CA-C 109.56 -1.416 . . . . 0.0 109.56 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 69.1 p -129.86 140.63 50.95 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -1.175 . . . . 0.0 110.153 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -159.01 148.6 18.93 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.168 -0.957 . . . . 0.0 111.477 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.0 126.26 38.08 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 108.675 -1.77 . . . . 0.0 108.675 179.232 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.497 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 21.1 p -64.25 126.33 27.41 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.261 -1.14 . . . . 0.0 110.837 -178.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 17.3 mttm -75.59 156.71 34.7 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 66.87 15.07 10.06 Favored 'General case' 0 N--CA 1.508 2.448 0 O-C-N 120.974 -1.079 . . . . 0.0 111.492 -178.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.401 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 8.2 p -175.51 151.44 1.21 Allowed 'General case' 0 N--CA 1.503 2.18 0 O-C-N 120.555 -1.341 . . . . 0.0 110.602 178.124 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.63 90.48 8.27 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.989 -1.069 . . . . 0.0 111.731 -177.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.426 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.3 tt0 -168.88 -175.13 2.27 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 121.257 -0.902 . . . . 0.0 110.64 178.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -128.34 153.59 46.87 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.082 -1.011 . . . . 0.0 109.395 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.518 HG21 ' HD3' ' A' ' 31' ' ' ARG . 79.5 mt -106.28 111.29 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.218 -0.926 . . . . 0.0 110.111 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.523 ' O ' HG12 ' A' ' 29' ' ' VAL . 57.5 t -114.19 158.92 14.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.297 -0.877 . . . . 0.0 110.012 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.4 ' HG3' HG12 ' A' ' 26' ' ' VAL . 0.0 OUTLIER -50.08 133.22 23.28 Favored 'General case' 0 N--CA 1.513 2.722 0 O-C-N 121.245 -0.909 . . . . 0.0 111.0 -179.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 105.17 6.12 39.72 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 120.163 -1.017 . . . . 0.0 111.754 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.523 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.9 p -127.05 135.86 62.41 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 CA-C-N 119.77 1.785 . . . . 0.0 110.476 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.427 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 8.2 t -87.72 140.61 29.34 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.115 -0.99 . . . . 0.0 109.975 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.518 ' HD3' HG21 ' A' ' 25' ' ' ILE . 13.0 ptt-85 -135.07 144.31 47.15 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.198 -0.939 . . . . 0.0 110.324 -179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.767 HG23 HG12 ' A' ' 8' ' ' VAL . 19.0 mt -108.82 122.56 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 O-C-N 121.254 -0.904 . . . . 0.0 109.351 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -104.18 162.44 15.24 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.454 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 12.3 pttp -127.86 140.9 51.74 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.277 -1.131 . . . . 0.0 109.405 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 46' ' ' ASP . 60.2 t -109.34 109.18 27.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 120.972 -1.08 . . . . 0.0 110.14 -179.712 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.2 t -121.12 112.62 33.12 Favored Pre-proline 0 N--CA 1.495 1.779 0 O-C-N 121.211 -0.93 . . . . 0.0 109.915 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -72.96 137.15 26.19 Favored 'Trans proline' 0 N--CA 1.486 1.059 0 O-C-N 123.118 1.062 . . . . 0.0 110.356 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -103.78 117.96 58.49 Favored Pre-proline 0 N--CA 1.5 2.036 0 O-C-N 121.208 -0.932 . . . . 0.0 110.209 179.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -74.14 71.76 4.26 Favored 'Trans proline' 0 N--CA 1.484 0.934 0 O-C-N 123.098 1.052 . . . . 0.0 110.332 179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -146.71 -58.8 0.29 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.092 -1.005 . . . . 0.0 110.445 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.5 m -107.5 157.64 17.85 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.113 -0.992 . . . . 0.0 110.182 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -95.27 -38.95 10.31 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.191 -0.943 . . . . 0.0 110.376 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 27.2 t -56.7 -39.74 74.38 Favored 'General case' 0 N--CA 1.512 2.637 0 O-C-N 121.062 -1.024 . . . . 0.0 110.163 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -85.83 101.46 2.58 Favored Glycine 0 N--CA 1.494 2.513 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -71.84 -80.19 0.38 Allowed Glycine 0 N--CA 1.493 2.456 0 N-CA-C 109.711 -1.355 . . . . 0.0 109.711 -179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.407 ' HB3' HG13 ' A' ' 35' ' ' VAL . 0.7 OUTLIER -126.96 149.62 49.76 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.114 -1.227 . . . . 0.0 110.36 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.9 mtt -113.81 135.4 54.0 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.273 -0.892 . . . . 0.0 110.123 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.435 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 22.3 ttmt -121.75 135.37 54.94 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.17 -0.956 . . . . 0.0 110.274 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -113.09 145.25 41.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.163 -0.96 . . . . 0.0 109.598 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.435 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 11.9 m95 -104.14 112.24 25.16 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.052 -1.03 . . . . 0.0 111.074 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.507 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -124.13 173.68 8.14 Favored 'General case' 0 N--CA 1.499 1.983 0 C-N-CA 119.227 -0.989 . . . . 0.0 109.399 176.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.497 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 69.8 m80 -93.41 177.66 5.96 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.475 -0.766 . . . . 0.0 110.693 -179.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.569 HG22 ' CE1' ' A' ' 93' ' ' HIS . 30.3 mt -77.24 -54.83 12.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -57.46 -38.03 73.82 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.032 -1.042 . . . . 0.0 109.695 178.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.401 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 18.8 m -62.3 -50.15 72.79 Favored 'General case' 0 N--CA 1.507 2.39 0 O-C-N 121.133 -0.979 . . . . 0.0 109.085 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.556 ' SD ' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -70.43 -44.83 67.09 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.388 -0.82 . . . . 0.0 109.522 179.648 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.499 ' CE2' HG23 ' A' ' 53' ' ' ILE . 11.4 m-85 -64.47 -29.52 70.56 Favored 'General case' 0 N--CA 1.501 2.099 0 C-N-CA 119.348 -0.941 . . . . 0.0 109.613 179.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -62.21 -42.05 98.94 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.854 -1.154 . . . . 0.0 109.091 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.4 -40.84 73.68 Favored 'General case' 0 N--CA 1.505 2.323 0 C-N-CA 119.361 -0.936 . . . . 0.0 108.734 178.52 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.556 HD13 ' SD ' ' A' ' 56' ' ' MET . 0.3 OUTLIER -60.42 -41.88 94.88 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.262 -0.899 . . . . 0.0 108.882 178.79 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -60.11 -35.09 74.47 Favored 'General case' 0 N--CA 1.508 2.437 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.474 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.7 mmt85 -106.72 31.56 5.18 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.264 -0.897 . . . . 0.0 110.558 179.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -106.9 166.91 10.25 Favored 'General case' 0 N--CA 1.498 1.954 0 O-C-N 120.85 -1.156 . . . . 0.0 110.1 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.5 mtp180 -65.07 155.38 34.94 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.2 -0.938 . . . . 0.0 110.143 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.78 3.15 46.33 Favored 'General case' 0 N--CA 1.507 2.424 0 O-C-N 121.273 -0.892 . . . . 0.0 112.086 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.3 m -84.37 -34.79 23.53 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.547 -1.346 . . . . 0.0 110.699 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.31 135.42 43.93 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.074 -1.016 . . . . 0.0 110.193 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.0 mmmt -115.21 144.35 43.84 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.188 -0.945 . . . . 0.0 110.22 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -134.87 143.15 46.82 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.223 -0.923 . . . . 0.0 110.265 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.2 mt 54.86 101.02 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 121.172 -0.955 . . . . 0.0 110.782 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.23 135.6 44.57 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.144 -0.973 . . . . 0.0 109.452 179.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 54.64 -162.75 0.13 Allowed 'General case' 0 N--CA 1.502 2.138 0 O-C-N 120.944 -1.098 . . . . 0.0 109.977 -179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.615 HD13 ' OG1' ' A' ' 91' ' ' THR . 0.7 OUTLIER -132.48 39.08 3.4 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.022 -1.049 . . . . 0.0 110.602 179.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.03 35.87 0.84 Allowed 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.206 -0.934 . . . . 0.0 110.481 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -133.65 37.26 3.3 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.099 -1.001 . . . . 0.0 109.923 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.874 HD22 ' HB3' ' A' ' 6' ' ' PHE . 96.5 mt -136.35 152.73 50.96 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.228 -0.92 . . . . 0.0 109.75 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -81.16 110.31 16.54 Favored 'General case' 0 N--CA 1.505 2.303 0 O-C-N 121.069 -1.019 . . . . 0.0 110.097 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 144.31 -34.75 1.61 Allowed Glycine 0 N--CA 1.494 2.544 0 C-N-CA 119.691 -1.242 . . . . 0.0 111.073 179.321 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.409 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 20.2 p-90 -63.95 -31.11 72.18 Favored 'General case' 0 N--CA 1.51 2.559 0 CA-C-N 119.12 1.46 . . . . 0.0 110.759 -179.571 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.0 tt0 -52.88 -35.17 57.52 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 120.829 -1.17 . . . . 0.0 110.596 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -82.64 -33.37 27.87 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.031 -1.043 . . . . 0.0 110.291 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.434 HD11 ' CD2' ' A' ' 10' ' ' TYR . 0.1 OUTLIER -51.26 176.68 0.02 OUTLIER 'General case' 0 N--CA 1.516 2.872 0 O-C-N 120.916 -1.115 . . . . 0.0 110.555 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -104.22 160.83 14.55 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 121.123 -0.986 . . . . 0.0 110.416 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -59.94 -43.33 95.06 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.197 -0.939 . . . . 0.0 110.313 -179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -61.62 -50.76 71.28 Favored 'General case' 0 N--CA 1.508 2.425 0 C-N-CA 119.485 -0.886 . . . . 0.0 109.701 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -62.25 -38.59 89.84 Favored 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.481 179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.811 ' HA ' HD12 ' A' ' 90' ' ' ILE . 4.3 ttpm? -60.52 -38.66 85.11 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.219 -0.926 . . . . 0.0 109.727 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -57.64 -38.19 74.63 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.195 -0.941 . . . . 0.0 110.049 179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.26 -38.32 76.68 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 121.086 -1.009 . . . . 0.0 110.255 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.811 HD12 ' HA ' ' A' ' 87' ' ' LYS . 9.3 mt -64.66 -39.34 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 O-C-N 121.047 -1.033 . . . . 0.0 109.352 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.615 ' OG1' HD13 ' A' ' 73' ' ' LEU . 33.6 m -57.35 -39.54 76.14 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.087 -1.008 . . . . 0.0 109.862 179.394 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 36.9 mm-40 -56.86 -39.11 73.7 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.206 -0.934 . . . . 0.0 109.837 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.569 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.7 m-70 -61.9 -54.27 44.33 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.235 -0.916 . . . . 0.0 109.642 179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.448 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.5 mp -62.77 -38.38 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 C-N-CA 119.273 -0.971 . . . . 0.0 109.218 179.252 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.1 -38.48 89.02 Favored 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.241 -0.912 . . . . 0.0 109.766 179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -60.77 -46.67 89.56 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.128 -0.982 . . . . 0.0 109.541 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 8.7 mp -59.25 -35.12 73.12 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.271 -0.893 . . . . 0.0 110.014 179.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 62.0 m -102.41 69.64 1.12 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.16 -0.963 . . . . 0.0 110.169 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.443 ' OG ' ' N ' ' A' ' 100' ' ' LYS . 16.0 t -106.55 -165.32 1.07 Allowed 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.094 -1.004 . . . . 0.0 110.04 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.443 ' N ' ' OG ' ' A' ' 99' ' ' SER . 0.4 OUTLIER -115.28 -58.78 2.09 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.11 -0.994 . . . . 0.0 110.498 -179.812 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -150.15 136.82 19.14 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 121.114 -0.991 . . . . 0.0 110.662 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -147.01 84.71 1.6 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.184 -0.947 . . . . 0.0 110.408 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -128.15 -172.71 13.27 Favored Glycine 0 N--CA 1.494 2.502 0 N-CA-C 109.681 -1.367 . . . . 0.0 109.681 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 7.6 p -132.29 148.92 71.63 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.143 -1.21 . . . . 0.0 110.261 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.14 85.66 1.2 Allowed 'Trans proline' 0 C--N 1.316 -1.135 0 O-C-N 123.383 1.202 . . . . 0.0 110.457 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -142.6 162.93 34.2 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.193 -0.942 . . . . 0.0 110.27 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -116.81 -63.42 1.45 Allowed 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.253 -0.904 . . . . 0.0 110.146 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -130.91 167.15 19.45 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.224 -0.922 . . . . 0.0 110.229 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.41 161.39 19.63 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.216 -0.928 . . . . 0.0 110.139 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 7.6 p -130.38 149.36 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 O-C-N 121.245 -0.909 . . . . 0.0 110.252 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 33.6 m -138.01 144.5 30.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.249 -0.907 . . . . 0.0 110.365 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -133.13 88.52 2.51 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.1 -1.0 . . . . 0.0 110.181 -179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.58 127.47 50.95 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.196 -0.94 . . . . 0.0 110.225 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -120.15 100.48 7.22 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.168 -0.958 . . . . 0.0 110.277 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.3 mt -116.58 128.4 55.37 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.219 -0.926 . . . . 0.0 110.19 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -139.06 98.15 3.46 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.227 -0.921 . . . . 0.0 110.227 -179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.792 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.169 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttp . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 110.224 -0.287 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -139.53 70.69 1.37 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.151 -0.968 . . . . 0.0 110.342 -179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -120.67 -58.18 1.85 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.11 -0.994 . . . . 0.0 110.084 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -129.41 109.32 10.98 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.194 -0.941 . . . . 0.0 110.023 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -139.38 139.14 37.09 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.17 -0.956 . . . . 0.0 110.337 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.574 ' HE2' ' HH ' ' A' ' 51' ' ' TYR . 2.0 m-85 -115.98 146.63 41.96 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.254 -0.904 . . . . 0.0 109.999 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 7.4 m -130.16 159.59 36.36 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.218 -0.926 . . . . 0.0 109.189 179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.867 ' CG1' HD23 ' A' ' 76' ' ' LEU . 22.8 m -125.69 105.48 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.019 -1.051 . . . . 0.0 111.061 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -100.44 141.74 32.88 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 120.949 -1.095 . . . . 0.0 109.576 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.465 ' CD2' ' HB3' ' A' ' 82' ' ' LEU . 46.8 m-85 -103.99 133.57 48.72 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.22 -0.925 . . . . 0.0 109.721 179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -57.14 133.41 54.99 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.16 -0.962 . . . . 0.0 110.384 -179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -118.25 -58.28 2.0 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.21 -0.931 . . . . 0.0 110.127 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.9 ttt85 -153.68 39.23 0.48 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.168 -0.958 . . . . 0.0 110.642 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -139.25 171.63 23.59 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 19.1 m -145.08 127.25 15.69 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.198 -1.177 . . . . 0.0 110.476 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -149.17 143.83 26.2 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.206 -0.934 . . . . 0.0 110.813 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.19 128.0 44.78 Favored Glycine 0 N--CA 1.497 2.723 0 N-CA-C 108.749 -1.74 . . . . 0.0 108.749 179.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.463 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 32.0 p -64.35 122.55 16.96 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.222 -1.163 . . . . 0.0 110.811 -178.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -68.34 157.25 36.09 Favored 'General case' 0 N--CA 1.503 2.202 0 O-C-N 121.349 -0.844 . . . . 0.0 108.838 179.69 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.87 15.79 10.1 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.842 -1.161 . . . . 0.0 111.83 -179.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.405 ' CB ' ' HB3' ' A' ' 55' ' ' CYS . 7.9 p -175.29 150.09 1.11 Allowed 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.566 -1.334 . . . . 0.0 110.699 178.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.4 mmtt -86.85 89.13 7.86 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.008 -1.058 . . . . 0.0 111.784 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -165.66 -173.34 2.7 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.308 -0.87 . . . . 0.0 110.409 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.9 pttm -130.32 149.75 51.87 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.014 -1.054 . . . . 0.0 109.499 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.566 HG21 HH21 ' A' ' 31' ' ' ARG . 56.5 mt -102.7 134.35 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.263 -0.898 . . . . 0.0 110.006 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 34.9 m -136.6 169.2 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.267 -0.896 . . . . 0.0 110.322 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -47.19 127.33 10.44 Favored 'General case' 0 N--CA 1.516 2.857 0 O-C-N 121.583 -0.698 . . . . 0.0 110.948 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.53 8.81 48.58 Favored Glycine 0 N--CA 1.493 2.49 0 C-N-CA 120.097 -1.049 . . . . 0.0 111.156 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 71.1 t -111.2 135.65 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 CA-C-N 119.547 1.673 . . . . 0.0 110.014 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 52.7 t -91.44 123.06 34.58 Favored 'General case' 0 N--CA 1.5 2.065 0 O-C-N 121.302 -0.874 . . . . 0.0 108.679 178.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.566 HH21 HG21 ' A' ' 25' ' ' ILE . 0.1 OUTLIER -106.95 133.82 51.03 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.16 -0.963 . . . . 0.0 110.652 -179.351 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.782 HD11 HG12 ' A' ' 53' ' ' ILE . 6.2 mt -106.47 113.1 42.23 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.02 135.54 12.2 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 119.723 -1.227 . . . . 0.0 110.361 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.445 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 3.4 ttpm? -111.99 123.93 51.3 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.38 -1.07 . . . . 0.0 108.986 179.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.593 HG22 ' HB3' ' A' ' 48' ' ' LYS . 52.2 t -109.29 108.99 26.71 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.132 -0.98 . . . . 0.0 110.272 -179.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.402 HG13 ' HG2' ' A' ' 34' ' ' LYS . 33.2 m -123.6 146.94 51.59 Favored Pre-proline 0 N--CA 1.496 1.867 0 O-C-N 121.215 -0.928 . . . . 0.0 110.24 179.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -74.87 146.25 33.0 Favored 'Trans proline' 0 C--N 1.317 -1.117 0 O-C-N 123.393 1.207 . . . . 0.0 110.173 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -102.95 116.42 62.52 Favored Pre-proline 0 N--CA 1.499 1.996 0 O-C-N 121.176 -0.953 . . . . 0.0 110.227 179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -75.16 -171.27 0.95 Allowed 'Trans proline' 0 C--N 1.32 -0.963 0 O-C-N 123.192 1.101 . . . . 0.0 110.302 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 69.2 t80 63.06 -68.41 0.08 Allowed 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.492 -0.755 . . . . 0.0 111.614 179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.8 t -76.53 152.01 36.17 Favored 'General case' 0 N--CA 1.507 2.41 0 O-C-N 120.74 -1.225 . . . . 0.0 110.05 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.68 -47.12 4.73 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 121.242 -0.911 . . . . 0.0 110.408 179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.5 t -57.26 -39.3 75.32 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.027 -1.045 . . . . 0.0 110.374 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -70.07 118.18 7.91 Favored Glycine 0 N--CA 1.493 2.483 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -96.1 -85.25 1.72 Allowed Glycine 0 N--CA 1.493 2.479 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -129.36 144.79 51.38 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.23 -1.159 . . . . 0.0 110.112 179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.1 tpt -117.9 146.22 44.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.167 -0.958 . . . . 0.0 110.766 -179.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.593 ' HB3' HG22 ' A' ' 35' ' ' VAL . 16.3 ptpt -131.87 144.78 51.12 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.24 -0.913 . . . . 0.0 109.671 179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -135.56 145.37 46.91 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.037 -1.04 . . . . 0.0 110.45 -179.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 31.3 m95 -97.85 115.86 28.91 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.166 -0.959 . . . . 0.0 110.53 179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.574 ' HH ' ' HE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -126.8 171.36 11.29 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.073 -1.017 . . . . 0.0 109.989 177.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.463 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 63.0 m80 -88.44 163.04 16.16 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.483 -0.761 . . . . 0.0 110.17 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.782 HG12 HD11 ' A' ' 32' ' ' ILE . 33.4 mt -67.6 -48.12 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 N-CA-C 107.764 -1.198 . . . . 0.0 107.764 178.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.7 ttmt -61.14 -40.75 95.0 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.163 -0.961 . . . . 0.0 109.334 178.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.405 ' HB3' ' CB ' ' A' ' 21' ' ' CYS . 35.6 m -64.1 -44.64 91.7 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.268 179.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.491 ' CE ' HD12 ' A' ' 70' ' ' ILE . 5.5 ttp -72.44 -43.26 64.03 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.429 -0.795 . . . . 0.0 109.993 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.477 ' CD2' HG23 ' A' ' 53' ' ' ILE . 16.1 m-85 -71.86 -29.75 64.7 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 119.142 -1.023 . . . . 0.0 109.794 179.321 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -78.5 -39.5 38.04 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 120.787 -1.195 . . . . 0.0 109.244 178.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 5.4 ttmm -73.2 -35.78 66.41 Favored 'General case' 0 N--CA 1.505 2.28 0 C-N-CA 119.389 -0.924 . . . . 0.0 109.367 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 tp -73.37 -40.03 64.69 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.229 -0.919 . . . . 0.0 109.409 179.099 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.428 ' OE2' HD12 ' A' ' 97' ' ' LEU . 19.6 mt-10 -69.85 -27.46 64.86 Favored 'General case' 0 N--CA 1.507 2.376 0 O-C-N 121.061 -1.025 . . . . 0.0 110.349 179.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.22 -36.3 10.08 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.917 -1.114 . . . . 0.0 110.966 -179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -135.14 151.43 50.69 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 120.956 -1.09 . . . . 0.0 111.075 -179.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.48 104.14 9.75 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.266 -0.896 . . . . 0.0 109.702 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -87.27 -36.07 18.12 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.082 -1.011 . . . . 0.0 110.792 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.404 HG23 ' HG3' ' A' ' 68' ' ' LYS . 8.4 t -144.09 -163.61 1.71 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.039 -1.038 . . . . 0.0 110.265 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 16.0 m -102.62 105.23 15.68 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.123 -0.985 . . . . 0.0 110.116 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.404 ' HG3' HG23 ' A' ' 66' ' ' THR . 18.5 mtpt -118.25 143.4 46.59 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.172 -0.955 . . . . 0.0 110.065 179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 30.1 tttp -130.61 99.41 4.96 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.218 -0.926 . . . . 0.0 110.374 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.491 HD12 ' CE ' ' A' ' 56' ' ' MET . 76.0 mt -114.59 99.01 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.237 -0.914 . . . . 0.0 109.814 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -108.84 132.91 53.56 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.293 -0.879 . . . . 0.0 109.801 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 51.24 -165.37 0.05 OUTLIER 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.094 -1.004 . . . . 0.0 110.493 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.862 HD13 HG21 ' A' ' 90' ' ' ILE . 54.0 tp -122.0 84.22 2.22 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.102 -0.999 . . . . 0.0 110.032 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.469 HG23 ' O ' ' A' ' 73' ' ' LEU . 0.5 OUTLIER -155.72 -54.85 0.09 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.236 -0.915 . . . . 0.0 110.964 -179.867 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -47.73 -32.71 6.13 Favored 'General case' 0 N--CA 1.518 2.948 0 O-C-N 121.074 -1.016 . . . . 0.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.867 HD23 ' CG1' ' A' ' 8' ' ' VAL . 7.4 mp -72.69 153.18 41.31 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.054 -1.029 . . . . 0.0 110.218 179.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.541 ' O ' HG22 ' A' ' 8' ' ' VAL . 46.8 tt0 -99.65 136.46 39.55 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 121.266 -0.896 . . . . 0.0 110.697 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.514 ' O ' HD12 ' A' ' 82' ' ' LEU . . . 129.33 -35.07 2.66 Favored Glycine 0 N--CA 1.494 2.563 0 N-CA-C 110.354 -1.098 . . . . 0.0 110.354 179.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . . . . . . . . . 44.3 p-90 -67.29 -15.36 63.65 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 120.923 -1.34 . . . . 0.0 112.123 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -51.19 -37.67 47.94 Favored 'General case' 0 N--CA 1.511 2.596 0 O-C-N 120.556 -1.34 . . . . 0.0 111.356 -178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -169.3 54.89 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.116 0 O-C-N 120.979 -1.076 . . . . 0.0 112.071 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.514 HD12 ' O ' ' A' ' 78' ' ' GLY . 14.0 mt -111.4 -70.36 0.82 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 109.926 178.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -122.49 131.17 53.73 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.072 -1.017 . . . . 0.0 110.133 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -88.16 -50.68 6.22 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 121.081 -1.012 . . . . 0.0 109.966 179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -66.55 -41.74 88.19 Favored 'General case' 0 N--CA 1.506 2.372 0 C-N-CA 119.411 -0.916 . . . . 0.0 108.971 179.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -62.84 -37.9 88.64 Favored 'General case' 0 N--CA 1.507 2.382 0 C-N-CA 119.476 -0.89 . . . . 0.0 109.381 178.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.865 ' HA ' HD12 ' A' ' 90' ' ' ILE . 35.1 tttt -58.09 -38.93 77.35 Favored 'General case' 0 N--CA 1.51 2.547 0 O-C-N 121.117 -0.989 . . . . 0.0 109.879 179.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 2.8 tm-20 -60.93 -40.34 92.85 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.244 -0.91 . . . . 0.0 109.794 179.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.77 92.35 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 121.13 -0.981 . . . . 0.0 110.101 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.865 HD12 ' HA ' ' A' ' 87' ' ' LYS . 11.3 mt -62.19 -40.42 87.55 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 O-C-N 121.191 -0.943 . . . . 0.0 109.746 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 88' ' ' GLU . 67.3 p -61.51 -39.13 89.87 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.123 -0.986 . . . . 0.0 109.94 179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -58.88 -39.87 82.67 Favored 'General case' 0 N--CA 1.509 2.505 0 O-C-N 121.179 -0.951 . . . . 0.0 109.962 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.552 ' CE1' HG22 ' A' ' 53' ' ' ILE . 7.8 m-70 -58.6 -46.15 87.63 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.171 -0.956 . . . . 0.0 110.163 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.0 mp -61.96 -41.56 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.478 0 O-C-N 121.169 -0.957 . . . . 0.0 108.927 179.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.38 -37.34 83.04 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.499 -0.881 . . . . 0.0 109.926 179.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -71.6 -38.31 70.86 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.136 -0.978 . . . . 0.0 109.81 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.428 HD12 ' OE2' ' A' ' 61' ' ' GLU . 38.0 tp -74.99 -32.76 61.74 Favored 'General case' 0 N--CA 1.506 2.375 0 O-C-N 121.123 -0.985 . . . . 0.0 110.598 179.55 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 39.5 t -91.89 -40.68 11.03 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.973 -1.079 . . . . 0.0 110.034 179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -118.62 155.82 30.29 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.186 -0.946 . . . . 0.0 110.115 179.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -131.82 43.2 3.07 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.132 -0.98 . . . . 0.0 110.22 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 52.7 75.56 0.23 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.048 -1.033 . . . . 0.0 110.761 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -128.09 80.18 1.94 Allowed 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.18 -0.95 . . . . 0.0 110.202 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -125.09 83.64 0.35 Allowed Glycine 0 N--CA 1.493 2.489 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 6.9 p -130.69 84.38 58.97 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.182 -1.187 . . . . 0.0 110.226 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -73.16 75.26 2.86 Favored 'Trans proline' 0 C--N 1.315 -1.2 0 O-C-N 123.419 1.221 . . . . 0.0 110.346 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 31.5 mttm -138.13 46.12 2.07 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.146 -0.971 . . . . 0.0 110.297 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -131.47 105.58 7.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.241 -0.912 . . . . 0.0 110.006 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -116.41 -56.47 2.29 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.217 -0.927 . . . . 0.0 110.327 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.09 136.87 52.67 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.214 -0.928 . . . . 0.0 110.164 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 34.0 m -130.45 147.59 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.193 -0.942 . . . . 0.0 110.355 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.5 t -138.39 143.3 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.185 -0.947 . . . . 0.0 110.06 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -117.63 91.54 3.6 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.198 -0.939 . . . . 0.0 110.29 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -122.91 135.44 54.5 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.259 -0.9 . . . . 0.0 110.239 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 28.6 mtmt -123.78 144.8 49.47 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.282 -0.886 . . . . 0.0 110.247 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 6.7 tp -123.6 140.51 52.93 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.229 -0.919 . . . . 0.0 110.207 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 29.6 p -119.31 119.36 33.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.21 -0.931 . . . . 0.0 110.164 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.8 m . . . . . 0 N--CA 1.495 1.809 0 CA-C-O 118.043 -0.979 . . . . 0.0 110.214 179.924 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 mmt . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 120.754 0.312 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.01 166.39 24.93 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.129 -0.982 . . . . 0.0 110.182 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -131.95 40.41 3.36 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.225 -0.922 . . . . 0.0 110.228 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -132.2 152.76 51.15 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.286 -0.884 . . . . 0.0 110.143 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.7 ttt-85 -142.36 145.79 34.27 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.218 -0.926 . . . . 0.0 110.381 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.778 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.7 m-85 -116.69 147.04 42.34 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.193 -0.942 . . . . 0.0 110.202 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.8 t -128.01 148.24 50.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.329 -0.857 . . . . 0.0 108.884 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.841 HG12 HG23 ' A' ' 32' ' ' ILE . 16.9 m -128.82 109.47 19.05 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.063 -1.023 . . . . 0.0 110.824 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -123.47 161.46 24.81 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.11 -0.994 . . . . 0.0 110.69 -179.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -102.39 155.64 18.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.495 -0.753 . . . . 0.0 110.072 179.901 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -94.33 140.01 30.35 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 121.357 -0.839 . . . . 0.0 110.019 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 24.3 mttm -114.88 -62.36 1.61 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.149 -0.97 . . . . 0.0 110.269 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.3 ptt-85 -139.35 39.61 2.08 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.255 -0.903 . . . . 0.0 110.335 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -141.25 124.7 2.59 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.856 HG22 ' HA ' ' A' ' 26' ' ' VAL . 77.3 p -113.75 146.03 40.49 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.198 -1.178 . . . . 0.0 110.163 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -158.15 147.87 19.85 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.227 -0.921 . . . . 0.0 111.175 -179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.92 121.39 18.49 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 108.761 -1.735 . . . . 0.0 108.761 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.483 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 27.0 p -63.93 123.34 18.73 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.306 -1.114 . . . . 0.0 110.897 -178.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 46.8 mttt -71.59 156.05 39.84 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 121.577 -0.702 . . . . 0.0 109.256 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 65.51 16.01 10.31 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 120.875 -1.141 . . . . 0.0 111.638 -178.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 13.0 p -174.74 150.48 1.32 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.592 -1.318 . . . . 0.0 110.534 178.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -88.5 92.28 9.12 Favored 'General case' 0 N--CA 1.512 2.668 0 O-C-N 121.02 -1.05 . . . . 0.0 111.476 -178.138 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.433 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.65 -174.68 2.55 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.249 -0.907 . . . . 0.0 110.667 179.243 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.8 ptpp? -131.63 153.3 50.08 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.105 -0.997 . . . . 0.0 109.228 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.898 HG21 ' HD3' ' A' ' 31' ' ' ARG . 80.8 mt -107.91 139.28 30.56 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 O-C-N 121.195 -0.94 . . . . 0.0 110.592 -179.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.856 ' HA ' HG22 ' A' ' 15' ' ' THR . 58.1 t -137.58 161.46 33.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.435 -0.791 . . . . 0.0 109.477 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -47.35 130.06 13.17 Favored 'General case' 0 N--CA 1.517 2.899 0 O-C-N 121.318 -0.864 . . . . 0.0 111.187 -179.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 106.37 8.47 33.12 Favored Glycine 0 N--CA 1.496 2.667 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.992 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.684 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.8 p -124.38 136.09 61.66 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 CA-C-N 119.909 1.855 . . . . 0.0 110.441 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 44.7 t -83.67 141.84 31.2 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.187 -0.946 . . . . 0.0 109.959 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.898 ' HD3' HG21 ' A' ' 25' ' ' ILE . 27.7 mtm180 -119.47 146.6 45.27 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.148 -0.97 . . . . 0.0 110.743 -179.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.841 HG23 HG12 ' A' ' 8' ' ' VAL . 5.4 mt -121.22 111.26 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.904 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -102.74 137.94 13.66 Favored Glycine 0 N--CA 1.494 2.54 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.116 -179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.425 ' HB2' ' CZ ' ' A' ' 6' ' ' PHE . 74.2 tttt -108.0 125.32 51.39 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.333 -1.098 . . . . 0.0 109.174 179.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.4 HG22 ' HB3' ' A' ' 48' ' ' LYS . 55.9 t -101.15 115.15 42.33 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.035 0 O-C-N 121.129 -0.982 . . . . 0.0 110.193 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 61.6 t -117.22 113.55 39.1 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.245 -0.909 . . . . 0.0 109.812 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -71.6 148.66 53.88 Favored 'Trans proline' 0 N--CA 1.486 1.047 0 O-C-N 123.201 1.106 . . . . 0.0 110.481 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -103.09 165.36 13.75 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.255 -0.903 . . . . 0.0 110.19 179.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.31 -38.78 8.28 Favored 'Trans proline' 0 C--N 1.317 -1.098 0 O-C-N 123.439 1.231 . . . . 0.0 110.26 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 1.6 t80 -109.45 154.04 23.18 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.179 -0.951 . . . . 0.0 109.729 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.401 ' O ' ' OG ' ' A' ' 41' ' ' SER . 25.9 p -115.62 103.42 10.7 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.201 -0.937 . . . . 0.0 110.465 -179.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -103.05 -66.93 0.91 Allowed 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.205 -0.934 . . . . 0.0 110.064 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -90.29 -43.59 10.27 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.171 -0.956 . . . . 0.0 110.171 179.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -145.38 -75.34 0.02 OUTLIER Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.846 -1.302 . . . . 0.0 109.846 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 141.21 -45.16 0.98 Allowed Glycine 0 N--CA 1.494 2.519 0 N-CA-C 109.659 -1.376 . . . . 0.0 109.659 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -115.17 127.2 55.39 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.213 -1.169 . . . . 0.0 110.033 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 54.8 ttp -117.42 147.58 42.56 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.147 -0.971 . . . . 0.0 110.545 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HB3' HG22 ' A' ' 35' ' ' VAL . 11.8 pttm -131.3 143.77 50.78 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 109.857 179.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -120.43 136.23 54.8 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.155 -0.966 . . . . 0.0 110.026 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 10.2 m95 -91.89 112.95 25.08 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.052 -1.03 . . . . 0.0 110.362 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.516 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.5 OUTLIER -125.91 172.05 10.22 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.889 177.494 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.483 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 66.4 m80 -89.63 172.61 8.83 Favored 'General case' 0 N--CA 1.499 2.018 0 C-N-CA 119.792 -0.763 . . . . 0.0 110.681 -179.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.527 HG22 ' CE1' ' A' ' 93' ' ' HIS . 37.4 mt -72.83 -53.51 18.61 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.3 tttt -58.65 -39.35 80.33 Favored 'General case' 0 N--CA 1.506 2.331 0 O-C-N 121.011 -1.056 . . . . 0.0 109.838 178.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 27.8 m -62.73 -46.65 87.09 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.116 -0.99 . . . . 0.0 109.486 179.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.453 ' O ' HD13 ' A' ' 60' ' ' LEU . 12.4 tpt -74.25 -42.75 59.15 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.285 -0.885 . . . . 0.0 109.933 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.525 ' CD2' HG23 ' A' ' 53' ' ' ILE . 20.6 m-85 -70.16 -25.9 63.67 Favored 'General case' 0 N--CA 1.501 2.092 0 C-N-CA 119.214 -0.994 . . . . 0.0 110.044 179.13 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -73.74 -38.73 64.65 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 120.741 -1.224 . . . . 0.0 109.358 178.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.2 ttmm -63.73 -41.82 97.99 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.123 -0.986 . . . . 0.0 109.411 179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.453 HD13 ' O ' ' A' ' 56' ' ' MET . 7.4 mp -59.97 -41.09 91.23 Favored 'General case' 0 N--CA 1.509 2.498 0 O-C-N 121.357 -0.84 . . . . 0.0 109.826 179.592 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -66.32 -35.19 79.75 Favored 'General case' 0 N--CA 1.508 2.452 0 O-C-N 121.25 -0.906 . . . . 0.0 110.496 179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 9.0 ttm-85 -79.78 -36.77 36.64 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 121.089 -1.007 . . . . 0.0 110.237 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.8 129.08 56.56 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.09 -1.006 . . . . 0.0 110.117 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.6 tpt85 -114.39 102.02 9.7 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.166 -0.959 . . . . 0.0 110.216 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.61 3.24 53.21 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.241 -0.912 . . . . 0.0 111.983 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.0 m 55.72 37.61 29.08 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.414 -1.429 . . . . 0.0 110.421 -179.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -116.89 160.94 20.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.194 -0.941 . . . . 0.0 110.008 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.3 mmmm -101.39 95.54 6.57 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.176 -0.953 . . . . 0.0 110.075 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 12.9 mttt -125.05 142.4 51.51 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.226 -0.921 . . . . 0.0 110.041 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.3 mt 53.17 92.32 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.184 0 O-C-N 121.036 -1.04 . . . . 0.0 110.319 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -110.57 136.74 49.23 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.194 -0.941 . . . . 0.0 110.022 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.33 -167.09 0.07 Allowed 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.03 -1.044 . . . . 0.0 110.464 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 1.105 HD22 HG23 ' A' ' 91' ' ' THR . 14.9 tp -117.02 38.56 3.48 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.194 -0.941 . . . . 0.0 110.791 -179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.23 37.11 0.84 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.164 -0.96 . . . . 0.0 110.535 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -131.64 37.32 3.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.206 -0.934 . . . . 0.0 109.894 179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.778 HD22 ' HB3' ' A' ' 6' ' ' PHE . 92.0 mt -140.43 152.95 46.1 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.186 -0.947 . . . . 0.0 109.79 -179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 17.2 tt0 -84.69 98.85 10.45 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.159 -0.963 . . . . 0.0 110.186 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 153.45 -36.19 0.75 Allowed Glycine 0 N--CA 1.495 2.615 0 C-N-CA 119.65 -1.262 . . . . 0.0 110.99 179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.404 ' CD1' ' O ' ' A' ' 76' ' ' LEU . 27.4 p-90 -57.94 -29.79 65.44 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 120.928 -1.336 . . . . 0.0 111.029 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.5 tt0 -52.41 -36.72 54.9 Favored 'General case' 0 N--CA 1.515 2.794 0 O-C-N 120.861 -1.15 . . . . 0.0 110.446 179.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -79.59 -33.06 41.96 Favored 'General case' 0 N--CA 1.508 2.427 0 O-C-N 121.161 -0.962 . . . . 0.0 110.243 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.06 170.3 0.02 OUTLIER 'General case' 0 N--CA 1.518 2.94 0 O-C-N 121.024 -1.048 . . . . 0.0 110.934 -179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -107.56 161.13 15.12 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.177 -0.952 . . . . 0.0 110.515 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -58.92 -42.72 90.34 Favored 'General case' 0 N--CA 1.509 2.493 0 O-C-N 121.214 -0.929 . . . . 0.0 110.258 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 66.3 m-80 -61.79 -51.94 66.24 Favored 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.264 -0.898 . . . . 0.0 109.483 179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.402 ' OE2' ' CZ ' ' A' ' 10' ' ' TYR . 40.8 mt-10 -63.72 -40.0 95.67 Favored 'General case' 0 N--CA 1.505 2.317 0 C-N-CA 119.494 -0.882 . . . . 0.0 109.006 178.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.548 ' HA ' HD12 ' A' ' 90' ' ' ILE . 13.3 ttpt -59.43 -38.35 80.46 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.351 -0.843 . . . . 0.0 109.845 179.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -63.21 -36.61 84.2 Favored 'General case' 0 N--CA 1.509 2.49 0 O-C-N 121.185 -0.947 . . . . 0.0 110.151 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -68.93 -38.29 79.4 Favored 'General case' 0 N--CA 1.508 2.436 0 O-C-N 121.07 -1.019 . . . . 0.0 110.091 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.548 ' CG2' HD11 ' A' ' 73' ' ' LEU . 9.3 mt -68.74 -38.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 C-N-CA 119.308 -0.957 . . . . 0.0 109.409 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 1.105 HG23 HD22 ' A' ' 73' ' ' LEU . 1.8 p -59.01 -37.71 77.55 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 120.946 -1.096 . . . . 0.0 109.521 178.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -56.4 -37.8 70.64 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.22 -0.925 . . . . 0.0 109.814 179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.527 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.61 -54.35 48.09 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.125 -0.984 . . . . 0.0 109.711 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.453 HG13 ' CZ ' ' A' ' 57' ' ' PHE . 9.4 mt -64.79 -39.34 85.33 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.366 0 C-N-CA 119.399 -0.92 . . . . 0.0 108.984 179.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.64 87.14 Favored 'General case' 0 N--CA 1.506 2.329 0 C-N-CA 119.409 -0.916 . . . . 0.0 109.504 178.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -61.6 -49.23 77.42 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.075 -1.016 . . . . 0.0 109.341 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 9.7 mp -60.65 -36.46 78.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.265 -0.897 . . . . 0.0 109.971 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.7 t -103.46 69.54 1.0 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.142 -0.973 . . . . 0.0 110.086 179.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.6 p -119.22 -172.3 2.28 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.17 -0.956 . . . . 0.0 110.162 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 23.1 mtpt -135.65 -179.06 5.42 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.205 -0.934 . . . . 0.0 110.167 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -125.48 40.26 3.78 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.225 -0.922 . . . . 0.0 110.238 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.99 111.92 11.94 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.242 -0.911 . . . . 0.0 110.233 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -68.29 -124.32 0.03 OUTLIER Glycine 0 N--CA 1.493 2.495 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.2 p -130.06 91.66 38.71 Favored Pre-proline 0 N--CA 1.494 1.736 0 O-C-N 121.315 -1.109 . . . . 0.0 110.249 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.77 167.24 27.75 Favored 'Trans proline' 0 C--N 1.318 -1.072 0 O-C-N 123.401 1.211 . . . . 0.0 110.374 -179.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.2 ttpp -135.73 102.37 5.06 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.179 -0.951 . . . . 0.0 110.225 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 30.3 mtpt -127.35 176.04 7.74 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.221 -0.924 . . . . 0.0 110.226 -179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -118.45 82.17 1.8 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.221 -0.924 . . . . 0.0 110.195 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -122.93 161.17 24.68 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.206 -0.934 . . . . 0.0 110.233 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.4 t -125.6 116.93 47.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.181 -0.95 . . . . 0.0 110.012 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.9 t -117.34 132.72 66.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 121.248 -0.907 . . . . 0.0 109.941 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -122.83 110.84 15.94 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.231 -0.918 . . . . 0.0 110.17 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -119.73 116.21 25.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.078 -1.014 . . . . 0.0 110.233 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 12.2 tttt -122.69 141.91 51.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.197 -0.94 . . . . 0.0 110.159 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.8 mt -126.02 149.67 48.67 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.246 -0.908 . . . . 0.0 110.291 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -119.86 134.12 55.35 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.258 -0.901 . . . . 0.0 110.159 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 61.8 m . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 118.022 -0.989 . . . . 0.0 110.245 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 110.244 -0.28 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -133.41 -165.51 1.63 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.202 -0.936 . . . . 0.0 110.246 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -120.88 104.46 9.86 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.215 -0.928 . . . . 0.0 110.191 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -117.24 139.24 51.04 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.205 -0.934 . . . . 0.0 110.196 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.8 ttt85 -142.24 144.88 33.55 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.122 -0.986 . . . . 0.0 110.349 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.829 ' HB3' HD22 ' A' ' 76' ' ' LEU . 2.1 m-85 -117.71 140.58 49.48 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.206 -0.934 . . . . 0.0 110.203 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.3 t -130.97 125.51 33.57 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.172 -0.955 . . . . 0.0 109.372 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 1.079 HG12 HG23 ' A' ' 32' ' ' ILE . 11.1 m -103.66 134.23 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.135 -0.978 . . . . 0.0 110.352 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -141.32 108.11 5.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.195 -0.94 . . . . 0.0 110.318 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.772 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.4 OUTLIER -51.02 157.47 0.84 Allowed 'General case' 0 N--CA 1.514 2.752 0 O-C-N 121.135 -0.978 . . . . 0.0 110.528 -179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.514 ' HB1' ' H ' ' A' ' 27' ' ' LYS . . . -83.44 139.99 32.63 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.306 -0.872 . . . . 0.0 110.002 179.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 12.4 mmtp -127.46 -58.47 1.26 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.222 -0.924 . . . . 0.0 110.501 -179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.22 140.53 26.64 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.17 -0.956 . . . . 0.0 110.328 -179.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 106.31 149.14 16.73 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.777 -1.329 . . . . 0.0 109.777 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.2 m -116.07 128.52 55.76 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.19 -1.183 . . . . 0.0 109.938 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.43 131.38 29.72 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.125 -0.985 . . . . 0.0 110.948 -179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.6 124.02 35.07 Favored Glycine 0 N--CA 1.493 2.495 0 N-CA-C 108.284 -1.927 . . . . 0.0 108.284 178.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 22.3 p -64.93 125.78 25.93 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 121.181 -1.188 . . . . 0.0 111.005 -178.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 157.38 37.26 Favored 'General case' 0 N--CA 1.504 2.271 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.667 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 65.39 16.8 10.71 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.878 -1.139 . . . . 0.0 111.395 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.6 p -177.75 152.42 0.78 Allowed 'General case' 0 N--CA 1.504 2.27 0 O-C-N 120.564 -1.335 . . . . 0.0 110.548 178.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.5 mtmt -89.57 92.12 8.96 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 120.992 -1.067 . . . . 0.0 111.541 -178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.431 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.7 tt0 -167.93 -173.61 2.14 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.401 -0.812 . . . . 0.0 110.325 179.072 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 41.6 mtmt -139.19 148.99 43.89 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.014 -1.054 . . . . 0.0 109.911 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.45 ' CG2' ' HB2' ' A' ' 11' ' ' ALA . 6.9 mt -112.25 131.0 64.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.174 -0.954 . . . . 0.0 109.7 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.62 ' O ' HG13 ' A' ' 26' ' ' VAL . 8.6 p -155.68 84.25 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.138 -0.976 . . . . 0.0 111.28 180.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.514 ' H ' ' HB1' ' A' ' 11' ' ' ALA . 0.5 OUTLIER 48.7 101.91 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.367 -0.833 . . . . 0.0 112.406 178.812 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 138.0 -22.03 3.13 Favored Glycine 0 N--CA 1.497 2.757 0 C-N-CA 119.392 -1.385 . . . . 0.0 112.219 178.607 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.5 p -125.62 139.41 51.42 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.906 0 CA-C-N 119.737 1.769 . . . . 0.0 111.383 -179.085 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.423 ' HB2' ' CE1' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -80.18 141.6 35.51 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 121.202 -0.936 . . . . 0.0 109.81 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.438 ' HD3' HD13 ' A' ' 25' ' ' ILE . 2.8 ptt85 -129.5 143.74 50.96 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.225 -0.922 . . . . 0.0 110.276 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 1.079 HG23 HG12 ' A' ' 8' ' ' VAL . 12.3 mt -111.11 126.48 68.51 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.186 -0.946 . . . . 0.0 109.181 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -106.9 154.15 16.72 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.491 ' HB3' ' OH ' ' A' ' 51' ' ' TYR . 11.3 pttp -127.8 143.43 51.13 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.129 -1.218 . . . . 0.0 109.589 179.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 60.3 t -108.53 109.66 29.12 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.012 -1.055 . . . . 0.0 109.949 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 59.9 t -115.39 113.22 43.29 Favored Pre-proline 0 N--CA 1.496 1.857 0 O-C-N 121.186 -0.947 . . . . 0.0 109.829 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.17 150.09 53.01 Favored 'Trans proline' 0 C--N 1.319 -0.989 0 O-C-N 123.196 1.103 . . . . 0.0 110.427 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -102.37 163.31 17.92 Favored Pre-proline 0 N--CA 1.499 2.024 0 O-C-N 121.295 -0.878 . . . . 0.0 110.099 179.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.81 148.78 52.9 Favored 'Trans proline' 0 C--N 1.316 -1.15 0 O-C-N 123.412 1.217 . . . . 0.0 110.339 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 54.31 97.83 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.101 0 O-C-N 121.024 -1.048 . . . . 0.0 110.711 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -133.28 123.76 26.08 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.128 -0.983 . . . . 0.0 110.015 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -102.78 -47.64 4.34 Favored 'General case' 0 N--CA 1.5 2.075 0 O-C-N 121.128 -0.982 . . . . 0.0 110.653 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.6 t -88.2 -44.11 11.11 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.099 -1.001 . . . . 0.0 110.407 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -148.34 -102.18 0.28 Allowed Glycine 0 N--CA 1.496 2.68 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 110.51 55.35 0.52 Allowed Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -146.25 130.06 17.15 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.191 -1.182 . . . . 0.0 110.173 -179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.6 mtt -117.96 128.22 54.59 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.133 -0.979 . . . . 0.0 110.588 -179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 29.1 ttmt -126.83 123.08 36.52 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.171 -0.956 . . . . 0.0 109.792 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -118.27 142.6 47.32 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.134 -0.978 . . . . 0.0 110.411 -179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . . . . . . . . . 8.2 m95 -99.25 114.1 26.74 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.173 -0.954 . . . . 0.0 110.611 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.519 ' OH ' ' CE2' ' A' ' 6' ' ' PHE . 0.3 OUTLIER -124.79 174.15 8.11 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.018 -1.051 . . . . 0.0 109.811 177.495 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.499 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 64.4 m80 -92.92 -173.7 3.37 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.454 -0.779 . . . . 0.0 110.664 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.611 HG22 ' CE1' ' A' ' 93' ' ' HIS . 37.9 mm -82.93 -56.63 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.015 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 178.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -58.56 -38.74 78.49 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.18 -0.95 . . . . 0.0 109.49 178.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.9 m -60.33 -51.31 70.07 Favored 'General case' 0 N--CA 1.506 2.362 0 O-C-N 121.272 -0.893 . . . . 0.0 109.104 179.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.467 ' HG2' HD11 ' A' ' 70' ' ' ILE . 10.5 tpt -68.8 -45.42 71.31 Favored 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.446 -0.784 . . . . 0.0 109.374 179.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 93' ' ' HIS . 9.5 m-85 -63.07 -30.24 71.44 Favored 'General case' 0 N--CA 1.503 2.175 0 C-N-CA 119.244 -0.983 . . . . 0.0 109.949 179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -65.7 -42.13 91.53 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 120.847 -1.158 . . . . 0.0 109.034 178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -65.58 -41.04 93.33 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.277 -0.889 . . . . 0.0 108.979 178.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 56' ' ' MET . 7.5 mp -55.34 -41.02 71.94 Favored 'General case' 0 N--CA 1.513 2.68 0 O-C-N 121.139 -0.976 . . . . 0.0 109.152 178.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.11 -33.91 65.55 Favored 'General case' 0 N--CA 1.509 2.491 0 O-C-N 121.287 -0.883 . . . . 0.0 109.562 178.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.9 mtt-85 -104.57 30.82 5.1 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.147 -0.97 . . . . 0.0 110.396 179.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -111.1 169.57 8.69 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.969 -1.082 . . . . 0.0 110.109 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -88.15 156.55 19.19 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.146 -0.971 . . . . 0.0 110.25 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -73.37 -33.59 65.14 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.26 -0.9 . . . . 0.0 110.748 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -50.42 -36.56 33.63 Favored 'General case' 0 N--CA 1.514 2.764 0 O-C-N 120.978 -1.076 . . . . 0.0 110.892 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.6 m -112.58 117.11 31.41 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.209 -0.932 . . . . 0.0 110.082 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 17.6 tttt -116.49 144.46 44.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.194 -0.941 . . . . 0.0 110.28 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.34 155.53 41.88 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.196 -0.94 . . . . 0.0 110.287 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.908 HG23 HD11 ' A' ' 76' ' ' LEU . 80.0 mt 54.14 99.11 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 O-C-N 121.178 -0.951 . . . . 0.0 110.797 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -110.9 132.35 54.28 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.0 109.729 179.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 51.94 -164.17 0.07 Allowed 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.023 -1.048 . . . . 0.0 110.777 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.728 HD23 ' HE2' ' A' ' 87' ' ' LYS . 46.0 tp -114.02 -55.42 2.5 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.155 -0.965 . . . . 0.0 110.344 -179.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -52.97 -36.99 60.82 Favored 'General case' 0 N--CA 1.513 2.701 0 O-C-N 121.014 -1.054 . . . . 0.0 110.724 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -50.62 -31.07 14.99 Favored 'General case' 0 N--CA 1.513 2.712 0 O-C-N 121.057 -1.027 . . . . 0.0 111.302 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.908 HD11 HG23 ' A' ' 70' ' ' ILE . 89.0 mt -87.35 152.19 22.48 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 120.889 -1.132 . . . . 0.0 110.305 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -96.31 137.13 35.84 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.243 -0.911 . . . . 0.0 110.467 -179.809 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 137.56 -49.44 0.85 Allowed Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.447 ' CE3' ' N ' ' A' ' 80' ' ' GLU . 55.6 p-90 -50.81 -32.0 18.75 Favored 'General case' 0 N--CA 1.515 2.792 0 O-C-N 121.116 -1.226 . . . . 0.0 111.151 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.447 ' N ' ' CE3' ' A' ' 79' ' ' TRP . 3.8 tm-20 -53.52 -28.04 29.09 Favored 'General case' 0 N--CA 1.511 2.577 0 O-C-N 120.94 -1.1 . . . . 0.0 111.416 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -110.05 24.22 13.3 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.878 -1.139 . . . . 0.0 112.244 -179.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.772 HD13 ' CD2' ' A' ' 10' ' ' TYR . 21.6 mt -111.1 -164.8 0.94 Allowed 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.723 -1.235 . . . . 0.0 109.678 179.303 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -88.02 161.85 17.14 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.926 -1.109 . . . . 0.0 110.312 -179.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -76.13 -49.26 17.81 Favored 'General case' 0 N--CA 1.507 2.401 0 C-N-CA 119.51 -0.876 . . . . 0.0 109.923 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -61.92 -42.7 99.39 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.305 -0.872 . . . . 0.0 109.366 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.417 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 21.3 mt-10 -62.58 -40.62 97.46 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.372 -0.83 . . . . 0.0 109.48 179.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.728 ' HE2' HD23 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -59.3 -39.81 84.19 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.208 -0.932 . . . . 0.0 109.932 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -58.36 -39.69 80.23 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.247 -0.908 . . . . 0.0 110.062 179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.9 mt-30 -59.47 -35.82 74.82 Favored 'General case' 0 N--CA 1.51 2.566 0 O-C-N 121.225 -0.922 . . . . 0.0 110.476 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.6 HG22 HD13 ' A' ' 73' ' ' LEU . 47.9 mm -70.46 -38.39 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.452 0 O-C-N 121.1 -1.0 . . . . 0.0 109.434 179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -38.86 92.82 Favored 'General case' 0 N--CA 1.506 2.365 0 O-C-N 121.031 -1.043 . . . . 0.0 109.391 179.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -57.23 -35.8 70.13 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.163 -0.961 . . . . 0.0 110.016 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.611 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.7 m-70 -55.57 -50.01 71.21 Favored 'General case' 0 N--CA 1.512 2.66 0 O-C-N 121.05 -1.031 . . . . 0.0 109.941 179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.9 mp -65.74 -38.24 81.81 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.351 0 C-N-CA 119.314 -0.954 . . . . 0.0 109.15 179.364 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.8 -39.63 83.97 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.363 -0.935 . . . . 0.0 109.575 179.23 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -62.43 -39.92 94.88 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.19 -0.944 . . . . 0.0 109.414 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 14.0 tp -82.52 -34.77 27.79 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.163 -0.961 . . . . 0.0 109.971 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 31.9 m -103.69 60.56 0.75 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.133 -0.979 . . . . 0.0 109.983 179.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.0 t -109.08 81.38 1.43 Allowed 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.053 -1.03 . . . . 0.0 110.25 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -131.96 116.71 17.48 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.167 -0.958 . . . . 0.0 110.087 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 53.01 81.28 0.09 Allowed 'General case' 0 N--CA 1.502 2.132 0 O-C-N 121.095 -1.003 . . . . 0.0 110.701 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -116.42 -58.51 2.08 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.191 -0.943 . . . . 0.0 110.201 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 120.61 59.64 0.24 Allowed Glycine 0 N--CA 1.493 2.453 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.5 p -140.17 95.33 8.42 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.264 -1.139 . . . . 0.0 110.154 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.43 162.81 40.43 Favored 'Trans proline' 0 C--N 1.317 -1.104 0 O-C-N 123.408 1.215 . . . . 0.0 110.398 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 10.5 tttt -140.91 106.76 5.14 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.234 -0.916 . . . . 0.0 110.199 -179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 11.0 tppt? -122.7 81.39 1.85 Allowed 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.202 -0.936 . . . . 0.0 110.236 179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 11.4 mtpt -141.67 -175.17 4.28 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.251 -0.906 . . . . 0.0 110.149 -179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.51 114.17 20.85 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.237 -0.915 . . . . 0.0 110.291 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.4 t -124.64 126.11 71.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 O-C-N 121.156 -0.965 . . . . 0.0 109.985 179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 7.4 p -137.76 144.66 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 O-C-N 121.225 -0.922 . . . . 0.0 110.193 179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 -119.53 89.23 3.09 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.037 -1.039 . . . . 0.0 110.171 -179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -132.62 127.52 35.14 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.133 -0.979 . . . . 0.0 110.327 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.6 ttpt -124.53 131.56 53.48 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.17 -0.956 . . . . 0.0 110.268 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 12.1 mt -123.31 139.88 53.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.202 -0.936 . . . . 0.0 110.242 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -124.02 149.44 46.05 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.231 -0.918 . . . . 0.0 110.194 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.228 179.998 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.501 ' O ' ' HB3' ' A' ' 2' ' ' ALA . 21.2 mtp . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.501 ' HB3' ' O ' ' A' ' 1' ' ' MET . . . 64.34 -71.4 0.07 Allowed 'General case' 0 N--CA 1.505 2.319 0 O-C-N 121.218 -0.926 . . . . 0.0 110.838 179.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -140.76 42.72 1.84 Allowed 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.988 -1.07 . . . . 0.0 110.221 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -147.44 133.33 19.09 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.257 -0.902 . . . . 0.0 110.456 -179.981 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 3.2 mtt85 -133.69 138.73 46.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.141 -0.974 . . . . 0.0 110.344 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.603 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.9 OUTLIER -131.55 141.04 49.61 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.291 -0.881 . . . . 0.0 109.675 179.986 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.438 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.8 m -152.69 166.72 31.26 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.33 -0.856 . . . . 0.0 109.956 179.199 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.712 HG22 ' HB2' ' A' ' 77' ' ' GLU . 6.1 m -104.64 141.4 20.2 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.123 0 O-C-N 120.864 -1.148 . . . . 0.0 110.583 179.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.436 ' CB ' ' CZ3' ' A' ' 50' ' ' TRP . 10.1 t0 -136.91 147.92 46.71 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.298 -0.877 . . . . 0.0 109.261 179.224 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.64 ' CD2' HD13 ' A' ' 82' ' ' LEU . 59.9 m-85 -102.48 154.29 19.23 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.22 -0.925 . . . . 0.0 110.311 -179.79 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -85.08 133.9 34.21 Favored 'General case' 0 N--CA 1.506 2.328 0 C-N-CA 119.559 -0.856 . . . . 0.0 110.26 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -134.15 106.06 6.98 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.279 -0.888 . . . . 0.0 110.167 -179.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 52.97 95.07 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.041 -1.037 . . . . 0.0 110.806 179.971 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.6 144.38 4.81 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 109.709 -1.356 . . . . 0.0 109.709 179.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 2.4 p -117.77 134.49 54.86 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.219 -1.165 . . . . 0.0 110.125 179.94 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -127.83 134.35 49.43 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.189 -0.944 . . . . 0.0 110.721 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.82 124.62 31.18 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.75 -1.34 . . . . 0.0 109.75 -179.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.415 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . 22.4 t -62.41 128.53 36.47 Favored 'General case' 0 N--CA 1.509 2.514 0 O-C-N 121.355 -1.086 . . . . 0.0 109.337 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.79 145.94 47.97 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.178 -0.951 . . . . 0.0 109.244 179.749 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.5 mttt 52.58 48.74 21.89 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 120.901 -1.124 . . . . 0.0 109.732 -179.231 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 t -165.69 151.42 9.2 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.351 -0.843 . . . . 0.0 110.656 -178.328 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 37.3 tttm -101.93 49.76 0.85 Allowed 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.138 -0.976 . . . . 0.0 108.57 178.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.6 -174.1 4.23 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.474 -0.766 . . . . 0.0 110.18 -178.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.3 mmtt -133.31 159.66 39.61 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.118 -0.989 . . . . 0.0 109.914 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.407 HG21 ' HD2' ' A' ' 31' ' ' ARG . 62.9 mt -104.51 105.02 17.76 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.409 -0.807 . . . . 0.0 109.526 179.833 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.732 ' O ' HG12 ' A' ' 29' ' ' VAL . 12.8 p -104.65 161.66 4.71 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 O-C-N 121.188 -0.945 . . . . 0.0 110.583 -179.598 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 16.5 tttm -46.13 138.57 5.17 Favored 'General case' 0 N--CA 1.516 2.859 0 O-C-N 121.466 -0.771 . . . . 0.0 111.195 -179.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.02 0.77 51.64 Favored Glycine 0 N--CA 1.493 2.466 0 C-N-CA 120.163 -1.018 . . . . 0.0 111.036 -179.202 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.732 HG12 ' O ' ' A' ' 26' ' ' VAL . 10.4 p -125.62 135.58 63.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 CA-C-N 119.549 1.674 . . . . 0.0 109.86 179.567 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.651 ' HB3' HD11 ' A' ' 53' ' ' ILE . 21.0 t -89.44 138.84 31.09 Favored 'General case' 0 N--CA 1.504 2.231 0 O-C-N 121.092 -1.005 . . . . 0.0 110.354 -179.609 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.407 ' HD2' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -127.45 154.1 45.49 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.334 -0.854 . . . . 0.0 110.138 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.468 HD12 ' CG ' ' A' ' 56' ' ' MET . 20.8 mt -102.07 136.53 33.75 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 O-C-N 121.18 -0.95 . . . . 0.0 110.185 -179.909 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.439 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.1 126.0 8.51 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 108.574 -1.81 . . . . 0.0 108.574 179.183 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 74.8 tttt -105.13 114.62 28.92 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.177 -1.19 . . . . 0.0 109.742 -179.862 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 57.6 t -96.04 121.2 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.144 0 O-C-N 121.212 -0.93 . . . . 0.0 110.429 -179.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.7 t -119.86 110.75 36.39 Favored Pre-proline 0 N--CA 1.492 1.654 0 O-C-N 121.215 -0.928 . . . . 0.0 109.417 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -73.03 147.61 43.49 Favored 'Trans proline' 0 C--N 1.319 -1.022 0 O-C-N 123.24 1.126 . . . . 0.0 110.638 -179.66 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -103.2 164.83 14.7 Favored Pre-proline 0 N--CA 1.499 2.014 0 O-C-N 121.268 -0.895 . . . . 0.0 110.006 179.705 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -70.65 178.19 5.39 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.392 1.207 . . . . 0.0 110.29 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 56.9 t80 62.96 -69.12 0.07 Allowed 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.509 -0.744 . . . . 0.0 111.333 -179.92 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 24.1 t -114.79 122.42 46.32 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.668 -1.27 . . . . 0.0 110.175 179.857 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -101.79 -47.71 4.52 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.194 -0.941 . . . . 0.0 110.303 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.8 t -57.09 -40.4 76.91 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.072 -1.017 . . . . 0.0 110.248 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -114.08 40.76 2.38 Favored Glycine 0 N--CA 1.494 2.506 0 N-CA-C 109.617 -1.393 . . . . 0.0 109.617 179.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -147.2 71.0 0.33 Allowed Glycine 0 N--CA 1.495 2.586 0 N-CA-C 109.879 -1.288 . . . . 0.0 109.879 -179.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -143.56 142.47 31.11 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.175 -1.191 . . . . 0.0 110.299 -179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.6 mtt -116.39 140.59 49.18 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.21 -0.931 . . . . 0.0 110.148 179.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.0 ttmt -129.75 122.64 29.27 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.133 -0.979 . . . . 0.0 110.54 -179.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -116.65 145.45 43.41 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.142 -0.974 . . . . 0.0 109.694 179.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.439 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 16.6 m95 -97.37 139.82 32.75 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.108 -0.995 . . . . 0.0 110.084 179.928 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -125.43 173.19 9.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.263 -0.898 . . . . 0.0 110.064 179.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.415 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 1.7 m80 -90.91 -172.67 3.43 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.526 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.975 HG22 ' CE1' ' A' ' 93' ' ' HIS . 44.5 mm -84.79 -40.29 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 O-C-N 120.962 -1.086 . . . . 0.0 109.161 178.953 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 2.0 tttm -86.45 -31.11 21.55 Favored 'General case' 0 N--CA 1.504 2.265 0 O-C-N 120.997 -1.064 . . . . 0.0 110.634 178.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 78.9 m -66.56 -51.01 61.17 Favored 'General case' 0 N--CA 1.509 2.519 0 O-C-N 120.951 -1.093 . . . . 0.0 109.923 179.807 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.468 ' CG ' HD12 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -66.22 -40.21 90.14 Favored 'General case' 0 N--CA 1.507 2.394 0 C-N-CA 119.519 -0.872 . . . . 0.0 110.007 -179.716 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.488 ' CD2' ' CD2' ' A' ' 93' ' ' HIS . 5.8 m-85 -70.44 -32.62 70.28 Favored 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 118.938 -1.105 . . . . 0.0 109.553 178.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -59.96 -36.97 78.25 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 120.97 -1.081 . . . . 0.0 109.592 178.706 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.6 mttp -59.29 -40.18 85.33 Favored 'General case' 0 N--CA 1.51 2.531 0 O-C-N 121.122 -0.986 . . . . 0.0 109.787 179.469 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -57.72 -42.66 84.28 Favored 'General case' 0 N--CA 1.509 2.509 0 O-C-N 121.194 -0.942 . . . . 0.0 109.327 179.286 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -58.95 -34.04 71.31 Favored 'General case' 0 N--CA 1.508 2.457 0 C-N-CA 119.559 -0.856 . . . . 0.0 109.625 178.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.5 mmt85 -107.55 31.01 5.76 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.19 -0.944 . . . . 0.0 110.639 179.385 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.48 166.99 10.55 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 120.995 -1.066 . . . . 0.0 110.136 179.854 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 8.9 ttt180 -64.5 155.31 33.26 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.229 -0.919 . . . . 0.0 110.05 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -86.54 -34.6 19.91 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.167 -0.958 . . . . 0.0 110.662 179.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.2 p -51.66 -36.57 46.85 Favored 'General case' 0 N--CA 1.513 2.692 0 O-C-N 120.896 -1.127 . . . . 0.0 110.829 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 4.1 m -111.61 131.54 55.2 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.153 -0.967 . . . . 0.0 110.171 179.845 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.1 tppt? -117.05 144.04 45.08 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.212 -0.93 . . . . 0.0 110.347 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.8 mttt -119.19 133.8 55.56 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.261 -0.899 . . . . 0.0 110.227 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.778 ' HA ' HD21 ' A' ' 76' ' ' LEU . 74.5 mt 54.36 98.74 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.104 0 O-C-N 121.14 -0.975 . . . . 0.0 110.668 -179.917 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 14.3 mp0 -112.82 137.55 50.99 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.086 -1.009 . . . . 0.0 109.996 179.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 t0 53.42 -164.04 0.09 Allowed 'General case' 0 N--CA 1.501 2.08 0 O-C-N 120.998 -1.063 . . . . 0.0 110.704 -179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.64 HD22 ' OG1' ' A' ' 91' ' ' THR . 56.6 tp -112.87 160.32 18.15 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.104 -0.997 . . . . 0.0 110.137 -179.778 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.445 HG23 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER 60.36 46.24 10.23 Favored 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.037 -1.039 . . . . 0.0 110.178 -179.829 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.767 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.8 mm-40 -112.91 -62.27 1.61 Allowed 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.142 -0.974 . . . . 0.0 109.537 179.348 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.778 HD21 ' HA ' ' A' ' 70' ' ' ILE . 0.9 OUTLIER -138.3 65.62 1.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.266 -0.896 . . . . 0.0 109.491 178.732 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.712 ' HB2' HG22 ' A' ' 8' ' ' VAL . 10.2 pt-20 -143.01 141.87 31.45 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.858 -1.151 . . . . 0.0 110.956 179.492 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.76 68.54 1.89 Allowed Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.186 -1.566 . . . . 0.0 109.186 179.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.445 ' CE2' HG23 ' A' ' 74' ' ' THR . 58.6 p-90 -91.81 -32.87 15.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 121.147 -1.208 . . . . 0.0 111.207 179.985 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -52.54 -29.42 25.34 Favored 'General case' 0 N--CA 1.513 2.699 0 O-C-N 120.838 -1.164 . . . . 0.0 111.17 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -94.86 -38.73 10.6 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 120.852 -1.155 . . . . 0.0 110.618 179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.64 HD13 ' CD2' ' A' ' 10' ' ' TYR . 92.5 mt -70.67 -175.69 1.13 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 120.949 -1.095 . . . . 0.0 110.015 179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -63.91 150.13 45.67 Favored 'General case' 0 N--CA 1.508 2.467 0 O-C-N 121.225 -0.922 . . . . 0.0 110.16 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -88.45 -39.95 13.85 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 121.246 -0.909 . . . . 0.0 110.32 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -58.03 -40.82 81.83 Favored 'General case' 0 N--CA 1.511 2.591 0 O-C-N 121.245 -0.909 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.431 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.4 mt-10 -59.78 -39.56 85.32 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.285 -0.884 . . . . 0.0 109.764 179.624 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.447 ' HG2' HD21 ' A' ' 73' ' ' LEU . 3.8 ttpm? -58.69 -38.52 78.41 Favored 'General case' 0 N--CA 1.508 2.465 0 O-C-N 121.185 -0.947 . . . . 0.0 110.09 179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -59.06 -45.69 90.15 Favored 'General case' 0 N--CA 1.51 2.532 0 O-C-N 121.215 -0.928 . . . . 0.0 109.733 179.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -59.17 -34.24 71.87 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.224 -0.922 . . . . 0.0 110.164 179.299 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 36.5 mm -58.9 -38.6 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 O-C-N 121.056 -1.028 . . . . 0.0 109.439 179.419 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.64 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -57.69 -41.38 81.53 Favored 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.095 -1.003 . . . . 0.0 109.649 179.451 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -62.56 -41.55 98.99 Favored 'General case' 0 N--CA 1.507 2.391 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.214 179.207 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.975 ' CE1' HG22 ' A' ' 53' ' ' ILE . 72.9 t60 -60.65 -46.47 90.18 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.266 -0.896 . . . . 0.0 109.567 179.541 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.457 HG12 ' CE1' ' A' ' 57' ' ' PHE . 25.7 mt -62.41 -39.5 84.55 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.448 0 O-C-N 121.181 -0.95 . . . . 0.0 109.396 179.422 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.403 ' O ' ' OG ' ' A' ' 99' ' ' SER . . . -60.47 -39.97 89.57 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.202 -0.936 . . . . 0.0 109.717 179.374 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -61.44 -44.22 97.5 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.261 -0.9 . . . . 0.0 109.345 179.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.469 HD22 ' HD1' ' A' ' 57' ' ' PHE . 5.0 tp -60.23 -35.1 74.68 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.353 -0.842 . . . . 0.0 110.035 179.385 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.0 t -100.59 67.29 1.28 Allowed 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.053 -1.029 . . . . 0.0 110.077 179.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 95' ' ' ALA . 8.4 m -137.67 162.66 33.24 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.115 -0.991 . . . . 0.0 110.184 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -124.62 41.4 3.51 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.207 -0.933 . . . . 0.0 110.187 -179.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -120.06 81.99 1.82 Allowed 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.222 -0.924 . . . . 0.0 110.165 179.963 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -125.99 -175.37 3.34 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.19 -0.943 . . . . 0.0 110.267 179.961 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -108.3 -153.9 17.15 Favored Glycine 0 N--CA 1.494 2.54 0 N-CA-C 109.564 -1.414 . . . . 0.0 109.564 -179.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 28.4 p -142.16 97.25 6.34 Favored Pre-proline 0 N--CA 1.492 1.671 0 O-C-N 121.15 -1.206 . . . . 0.0 110.268 -179.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -72.45 151.42 53.44 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 O-C-N 123.355 1.187 . . . . 0.0 110.433 -179.979 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 3.4 tptp -117.65 102.95 9.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.192 -0.943 . . . . 0.0 110.214 179.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 7.8 mttm -139.86 130.37 25.59 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.228 -0.92 . . . . 0.0 110.21 179.975 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -119.65 50.37 1.27 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.19 -0.944 . . . . 0.0 110.2 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -117.07 156.71 27.09 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.215 -0.928 . . . . 0.0 110.22 179.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.2 t -116.52 136.57 53.11 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 O-C-N 121.168 -0.958 . . . . 0.0 109.919 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 61.0 t -121.0 118.34 55.92 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 121.177 -0.952 . . . . 0.0 109.911 -179.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -121.0 106.61 11.76 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.219 -0.925 . . . . 0.0 110.184 179.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -121.22 141.18 51.11 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.259 -0.901 . . . . 0.0 110.215 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -116.78 137.04 52.48 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.183 -0.948 . . . . 0.0 110.21 179.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 82.2 mt -123.93 106.72 10.65 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.246 -0.908 . . . . 0.0 110.201 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.5 m -137.8 98.52 3.68 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.211 -0.93 . . . . 0.0 110.201 -179.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.495 1.791 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.182 -179.994 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 ttt . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -127.14 68.59 1.28 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.241 -0.912 . . . . 0.0 110.2 179.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -118.17 -57.29 2.1 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.195 -0.941 . . . . 0.0 110.264 -179.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -114.64 149.34 36.82 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.125 -0.984 . . . . 0.0 110.2 -179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -125.24 153.79 42.63 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.222 -0.924 . . . . 0.0 110.393 -179.92 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.525 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.6 OUTLIER -146.13 134.85 22.28 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.344 -0.848 . . . . 0.0 109.866 -179.943 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.2 p -152.73 165.49 35.13 Favored 'General case' 0 N--CA 1.504 2.268 0 O-C-N 121.052 -1.03 . . . . 0.0 109.871 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.614 HG22 ' HB2' ' A' ' 77' ' ' GLU . 11.1 m -101.81 116.23 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.113 0 O-C-N 120.91 -1.119 . . . . 0.0 110.606 179.618 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -105.0 141.78 35.97 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.019 -1.051 . . . . 0.0 109.239 179.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.439 ' CZ ' ' HB2' ' A' ' 83' ' ' GLU . 73.2 m-85 -100.35 152.14 20.67 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.156 -0.965 . . . . 0.0 110.192 -179.793 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -100.68 135.54 41.96 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.363 -0.836 . . . . 0.0 110.025 179.664 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.3 mtpt -114.18 -55.1 2.53 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.146 -0.971 . . . . 0.0 110.348 -179.82 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.1 mtp85 -133.8 156.13 48.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.185 -0.947 . . . . 0.0 110.256 -179.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.28 162.61 24.13 Favored Glycine 0 N--CA 1.492 2.432 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.803 HG23 ' O ' ' A' ' 25' ' ' ILE . 89.4 m -138.31 145.42 41.2 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.226 -1.161 . . . . 0.0 110.192 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -140.92 141.85 34.49 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.218 -0.926 . . . . 0.0 110.736 -179.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.41 127.58 44.14 Favored Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.774 -1.73 . . . . 0.0 108.774 179.33 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.469 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 31.3 p -65.74 121.65 15.48 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.148 -1.207 . . . . 0.0 110.931 -178.425 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.447 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 29.7 mmtt -66.89 156.32 36.08 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 121.335 -0.853 . . . . 0.0 108.972 179.717 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 64.84 16.35 10.41 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 120.84 -1.163 . . . . 0.0 111.92 -179.116 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 7.4 p -175.24 149.33 1.05 Allowed 'General case' 0 N--CA 1.504 2.256 0 O-C-N 120.571 -1.33 . . . . 0.0 110.726 178.095 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -86.64 88.36 7.65 Favored 'General case' 0 N--CA 1.512 2.635 0 O-C-N 121.021 -1.049 . . . . 0.0 111.678 -178.021 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.406 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 2.1 tt0 -165.27 -173.73 2.96 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.262 -0.899 . . . . 0.0 110.402 179.01 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -130.81 153.8 48.7 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.019 -1.051 . . . . 0.0 109.833 -179.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.803 ' O ' HG23 ' A' ' 15' ' ' THR . 87.4 mt -107.73 122.5 62.13 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.277 -0.889 . . . . 0.0 109.969 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.474 HG22 ' HG2' ' A' ' 27' ' ' LYS . 12.2 p -120.09 160.3 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.865 0 O-C-N 121.243 -0.911 . . . . 0.0 110.323 179.867 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HG2' HG22 ' A' ' 26' ' ' VAL . 3.7 pttt -47.83 132.04 14.84 Favored 'General case' 0 N--CA 1.515 2.821 0 O-C-N 121.386 -0.821 . . . . 0.0 111.28 -179.464 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.4 8.59 40.53 Favored Glycine 0 N--CA 1.494 2.554 0 C-N-CA 120.117 -1.039 . . . . 0.0 111.727 -179.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.472 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.7 p -124.97 137.01 58.99 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 CA-C-N 119.723 1.762 . . . . 0.0 110.612 179.984 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.1 t -94.43 133.46 38.01 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.161 -0.962 . . . . 0.0 109.942 179.604 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.24 148.61 50.2 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.266 -0.896 . . . . 0.0 110.151 179.732 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.42 ' O ' ' CE2' ' A' ' 51' ' ' TYR . 10.1 mt -104.36 123.89 58.5 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.083 -1.01 . . . . 0.0 109.425 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.446 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -106.02 143.93 15.77 Favored Glycine 0 N--CA 1.486 2.025 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 179.569 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.463 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 27.4 tttt -108.37 117.17 33.46 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -1.136 . . . . 0.0 108.774 179.679 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -96.4 108.7 21.67 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.01 -1.056 . . . . 0.0 110.467 -179.421 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 37' ' ' PRO . 9.0 p -123.62 143.43 41.7 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.301 -0.874 . . . . 0.0 110.041 179.354 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 36' ' ' VAL . 49.8 Cg_endo -76.22 143.77 25.69 Favored 'Trans proline' 0 C--N 1.317 -1.084 0 O-C-N 123.101 1.053 . . . . 0.0 110.342 -179.884 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -103.58 121.48 48.18 Favored Pre-proline 0 N--CA 1.5 2.033 0 O-C-N 121.189 -0.944 . . . . 0.0 110.088 179.783 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -72.2 79.37 1.75 Allowed 'Trans proline' 0 C--N 1.319 -0.996 0 O-C-N 123.127 1.067 . . . . 0.0 110.245 179.785 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -145.51 -58.56 0.33 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.222 -0.924 . . . . 0.0 110.458 -179.721 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -95.48 157.99 15.65 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.124 -0.985 . . . . 0.0 110.112 179.728 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -94.38 -35.36 12.4 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.232 -0.917 . . . . 0.0 110.768 -179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -54.55 -37.73 65.77 Favored 'General case' 0 N--CA 1.512 2.664 0 O-C-N 120.91 -1.119 . . . . 0.0 110.556 -179.799 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 142.22 -176.66 22.04 Favored Glycine 0 N--CA 1.495 2.588 0 N-CA-C 109.661 -1.375 . . . . 0.0 109.661 179.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 143.23 137.27 3.27 Favored Glycine 0 N--CA 1.493 2.497 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -132.77 151.42 52.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.205 -1.173 . . . . 0.0 110.038 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 6.6 ttp -113.6 130.99 56.28 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.226 -0.921 . . . . 0.0 110.53 -179.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -139.15 136.77 35.46 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.184 -0.948 . . . . 0.0 110.084 179.702 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -122.1 153.48 38.62 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.174 -0.954 . . . . 0.0 109.399 179.856 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 16.1 m95 -107.5 114.1 27.87 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.109 -0.994 . . . . 0.0 111.033 -179.872 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.525 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -123.35 171.32 9.51 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.193 -0.942 . . . . 0.0 109.224 177.412 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.469 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 58.9 m80 -86.72 -175.19 5.32 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.269 -179.78 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.513 HG22 ' ND1' ' A' ' 93' ' ' HIS . 31.9 mm -85.33 -47.06 17.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 178.211 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -64.85 -40.01 94.46 Favored 'General case' 0 N--CA 1.504 2.234 0 C-N-CA 119.432 -0.907 . . . . 0.0 109.056 178.126 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 51.1 m -62.09 -45.99 91.04 Favored 'General case' 0 N--CA 1.507 2.389 0 C-N-CA 119.414 -0.915 . . . . 0.0 109.084 179.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.418 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -70.19 -46.65 64.15 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 121.414 -0.804 . . . . 0.0 109.661 179.86 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -67.13 -28.96 68.58 Favored 'General case' 0 N--CA 1.504 2.226 0 C-N-CA 119.189 -1.004 . . . . 0.0 109.975 179.368 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -76.83 -42.74 39.15 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.777 -1.202 . . . . 0.0 108.899 178.545 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 18.2 tptp -66.77 -39.76 87.98 Favored 'General case' 0 N--CA 1.505 2.284 0 C-N-CA 119.42 -0.912 . . . . 0.0 108.796 178.415 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.587 HD21 ' CB ' ' A' ' 69' ' ' LYS . 6.0 tp -55.74 -41.22 73.61 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.256 -0.902 . . . . 0.0 109.21 178.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -59.75 -34.86 73.5 Favored 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.288 -0.883 . . . . 0.0 109.555 178.542 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 10.3 mtp-105 -108.77 32.65 4.72 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.145 -0.972 . . . . 0.0 110.538 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.726 ' HB1' HG21 ' A' ' 67' ' ' THR . . . -92.67 168.87 10.93 Favored 'General case' 0 N--CA 1.503 2.213 0 O-C-N 120.954 -1.092 . . . . 0.0 110.305 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.5 mtt85 -62.76 157.57 20.8 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.262 -0.899 . . . . 0.0 110.415 -179.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.85 -33.4 68.62 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.22 -0.925 . . . . 0.0 110.79 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 31.0 p -92.97 57.69 2.82 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 120.895 -1.128 . . . . 0.0 110.013 179.811 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.726 HG21 ' HB1' ' A' ' 63' ' ' ALA . 6.7 p -117.31 163.12 16.82 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.259 -0.901 . . . . 0.0 110.072 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.494 ' O ' HD11 ' A' ' 60' ' ' LEU . 7.0 ttpt -95.35 130.63 42.06 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.2 -0.937 . . . . 0.0 109.673 179.527 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.587 ' CB ' HD21 ' A' ' 60' ' ' LEU . 18.1 mtmt -113.02 159.25 19.34 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.209 -0.932 . . . . 0.0 110.563 -179.405 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.2 mt -111.37 120.2 61.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 121.312 -0.867 . . . . 0.0 109.704 179.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -114.05 152.78 30.5 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.273 -0.892 . . . . 0.0 109.724 179.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 t0 52.86 -165.23 0.07 Allowed 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.027 -1.046 . . . . 0.0 110.487 -179.753 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 1.044 HD11 HG22 ' A' ' 90' ' ' ILE . 1.6 tp -138.02 -164.78 1.68 Allowed 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.147 -0.971 . . . . 0.0 110.162 -179.968 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.58 HG22 ' CE2' ' A' ' 79' ' ' TRP . 4.5 p 46.84 43.3 13.13 Favored 'General case' 0 N--CA 1.505 2.282 0 O-C-N 121.169 -0.957 . . . . 0.0 111.204 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.777 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.1 tp10 -113.43 -55.84 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.251 -0.905 . . . . 0.0 110.055 179.833 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.777 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.3 pt? -146.59 63.42 1.2 Allowed 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.109 -0.994 . . . . 0.0 109.999 179.082 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.614 ' HB2' HG22 ' A' ' 8' ' ' VAL . 5.2 pt-20 -144.46 141.28 29.48 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.063 -1.023 . . . . 0.0 110.699 178.888 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.08 66.2 3.46 Favored Glycine 0 N--CA 1.496 2.672 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 179.439 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.58 ' CE2' HG22 ' A' ' 74' ' ' THR . 51.1 p-90 -90.91 -39.22 12.41 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.073 -1.251 . . . . 0.0 110.512 179.865 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -64.86 -24.13 67.44 Favored 'General case' 0 N--CA 1.509 2.477 0 O-C-N 121.227 -0.921 . . . . 0.0 111.072 179.629 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -95.96 -29.63 14.06 Favored 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.714 -1.241 . . . . 0.0 111.497 -179.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 80.1 mt -94.77 -79.79 0.42 Allowed 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.8 -1.187 . . . . 0.0 110.773 -179.741 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 5.8 mt-10 -125.39 132.62 52.74 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.7 -1.25 . . . . 0.0 110.829 -179.77 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 70.0 m-20 -89.07 -43.94 10.72 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.13 -0.981 . . . . 0.0 109.554 178.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -62.02 -40.99 97.56 Favored 'General case' 0 N--CA 1.508 2.427 0 C-N-CA 119.607 -0.837 . . . . 0.0 109.365 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -56.08 -38.99 71.43 Favored 'General case' 0 N--CA 1.509 2.5 0 O-C-N 121.219 -0.925 . . . . 0.0 109.683 179.058 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.852 ' HA ' HD12 ' A' ' 90' ' ' ILE . 1.3 ttpt -55.53 -38.17 68.9 Favored 'General case' 0 N--CA 1.509 2.503 0 O-C-N 121.277 -0.89 . . . . 0.0 109.977 179.08 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -61.4 -44.17 97.61 Favored 'General case' 0 N--CA 1.507 2.384 0 O-C-N 121.193 -0.942 . . . . 0.0 109.607 179.533 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -64.11 -39.07 93.25 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.261 -0.899 . . . . 0.0 109.883 179.633 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 1.044 HG22 HD11 ' A' ' 73' ' ' LEU . 12.6 mt -61.41 -35.1 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.219 -0.925 . . . . 0.0 109.546 179.367 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.451 ' OG1' HD22 ' A' ' 73' ' ' LEU . 3.7 m -60.77 -38.95 86.99 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 120.812 -1.18 . . . . 0.0 109.576 179.134 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 5.6 mt-30 -57.13 -38.53 73.6 Favored 'General case' 0 N--CA 1.511 2.584 0 O-C-N 121.266 -0.896 . . . . 0.0 109.901 179.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.513 ' ND1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -53.05 -43.47 66.68 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 121.06 -1.025 . . . . 0.0 110.178 179.753 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.461 HD13 HD13 ' A' ' 73' ' ' LEU . 1.5 mp -65.97 -40.55 87.68 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.364 0 C-N-CA 119.323 -0.951 . . . . 0.0 108.873 179.506 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.49 -36.95 81.93 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.43 -0.908 . . . . 0.0 109.969 179.312 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -70.63 -37.75 73.83 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 179.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.2 tp -79.73 -31.94 41.12 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.046 -1.034 . . . . 0.0 110.736 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.3 m -92.04 -39.48 11.62 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 120.94 -1.1 . . . . 0.0 110.192 179.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.9 m -115.65 114.0 24.29 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.081 -1.012 . . . . 0.0 110.1 179.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -117.66 -57.57 2.11 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.179 -0.95 . . . . 0.0 110.284 -179.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -116.92 -61.08 1.77 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.189 -0.944 . . . . 0.0 110.188 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.91 43.48 3.12 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.247 -0.908 . . . . 0.0 110.156 179.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -94.06 91.95 1.51 Allowed Glycine 0 N--CA 1.493 2.475 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 -179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 29.9 p -120.46 66.95 13.02 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.21 -1.171 . . . . 0.0 110.175 179.939 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -72.9 -43.15 0.86 Allowed 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.284 1.15 . . . . 0.0 110.454 -179.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 40.5 mttt -118.26 137.26 53.17 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.196 -0.94 . . . . 0.0 110.284 -179.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 8.2 ttmm -116.83 -56.53 2.26 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.167 -0.958 . . . . 0.0 110.239 -179.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 16.0 tttt -129.14 52.87 1.92 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.126 -0.984 . . . . 0.0 110.227 179.955 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -116.95 104.94 11.79 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.222 -0.924 . . . . 0.0 110.229 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 58.9 t -129.88 148.08 33.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.212 -0.93 . . . . 0.0 109.994 -179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 8.5 p -136.1 143.24 36.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.245 -0.909 . . . . 0.0 110.167 179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 tt0 -131.01 128.19 39.86 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.166 -0.959 . . . . 0.0 110.266 -179.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -129.38 107.14 9.28 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.214 -0.929 . . . . 0.0 110.251 -179.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -121.05 112.31 18.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.171 -0.955 . . . . 0.0 110.252 179.991 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.2 mt -125.43 132.96 52.63 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.236 -0.915 . . . . 0.0 110.228 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 36.6 p -130.7 115.84 17.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.191 -0.943 . . . . 0.0 110.212 -179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 4.8 m . . . . . 0 N--CA 1.494 1.751 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.144 -179.962 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.7 mtt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 120.725 0.298 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.12 135.2 53.35 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.099 -1.001 . . . . 0.0 110.195 -179.945 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -123.32 72.07 1.1 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.187 -0.946 . . . . 0.0 110.237 -179.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -122.46 139.59 53.7 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.159 -0.963 . . . . 0.0 110.117 179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 4.3 ttm105 -141.97 135.18 29.09 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.178 -0.951 . . . . 0.0 110.228 -179.913 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.777 ' HB3' HD22 ' A' ' 76' ' ' LEU . 1.1 m-85 -118.37 137.55 53.04 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.212 -0.93 . . . . 0.0 110.127 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.419 ' O ' HG23 ' A' ' 32' ' ' ILE . 11.7 m -122.78 159.47 27.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.186 -0.946 . . . . 0.0 109.295 179.511 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.521 HG12 HG23 ' A' ' 32' ' ' ILE . 25.8 m -130.08 116.17 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.038 -1.038 . . . . 0.0 110.311 179.577 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -119.16 151.82 37.66 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.999 -1.063 . . . . 0.0 110.298 -179.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.676 ' HB2' HD22 ' A' ' 82' ' ' LEU . 0.1 OUTLIER -104.97 144.77 31.35 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.309 -0.87 . . . . 0.0 109.602 179.739 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -90.03 113.35 25.02 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.168 -0.957 . . . . 0.0 110.386 -179.762 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -113.48 -56.06 2.45 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.236 -0.915 . . . . 0.0 109.886 179.733 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 2.2 ttm-85 -125.52 39.02 4.05 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.178 -0.951 . . . . 0.0 110.133 179.768 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -154.12 155.06 25.94 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.864 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.0 t -146.59 146.03 30.3 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.286 -1.126 . . . . 0.0 110.279 179.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -156.08 149.01 24.17 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.193 -0.942 . . . . 0.0 111.589 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.96 125.88 41.02 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 36.7 t -60.09 140.9 56.57 Favored 'General case' 0 N--CA 1.501 2.121 0 O-C-N 121.309 -1.112 . . . . 0.0 110.361 -179.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.406 ' HB2' ' HB3' ' A' ' 49' ' ' GLU . 0.5 OUTLIER -88.99 153.8 20.72 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 177.944 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 59.36 33.01 22.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.84 -1.163 . . . . 0.0 109.664 -178.761 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 132.0 0.09 Allowed 'General case' 0 N--CA 1.516 2.849 0 O-C-N 120.772 -1.205 . . . . 0.0 109.372 -179.768 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.36 72.61 4.9 Favored 'General case' 0 N--CA 1.508 2.473 0 O-C-N 121.07 -1.019 . . . . 0.0 109.91 -179.897 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -151.33 -175.52 5.21 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.247 -0.908 . . . . 0.0 110.318 -179.413 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.3 ttmt -133.38 156.83 46.95 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.914 -1.116 . . . . 0.0 109.756 -179.27 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.604 HD11 ' O ' ' A' ' 50' ' ' TRP . 56.4 mt -105.03 114.95 45.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.344 -0.847 . . . . 0.0 109.617 179.929 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.623 ' O ' HG12 ' A' ' 29' ' ' VAL . 58.9 t -110.61 160.93 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.989 0 O-C-N 121.21 -0.931 . . . . 0.0 110.3 -179.562 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -47.11 144.75 2.48 Favored 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.406 -0.809 . . . . 0.0 111.125 -179.69 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 90.17 9.67 65.17 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 120.072 -1.061 . . . . 0.0 111.068 -179.35 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.623 HG12 ' O ' ' A' ' 26' ' ' VAL . 8.5 p -125.1 133.95 68.13 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 119.485 1.642 . . . . 0.0 110.191 -179.946 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 25.4 p -89.99 139.04 30.99 Favored 'General case' 0 N--CA 1.504 2.267 0 O-C-N 121.167 -0.958 . . . . 0.0 110.0 179.552 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.09 150.67 52.04 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.238 -0.913 . . . . 0.0 110.616 -179.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.521 HG23 HG12 ' A' ' 8' ' ' VAL . 20.5 mt -113.32 134.46 55.96 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.288 -0.883 . . . . 0.0 109.537 179.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -105.78 127.92 9.16 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 179.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.473 ' CB ' ' OH ' ' A' ' 51' ' ' TYR . 17.5 tttp -103.15 118.36 36.61 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.128 -1.219 . . . . 0.0 109.585 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.462 HG22 ' HB2' ' A' ' 48' ' ' LYS . 47.2 t -94.31 119.2 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.167 0 O-C-N 121.175 -0.953 . . . . 0.0 110.189 -179.787 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.444 HG22 ' HE3' ' A' ' 34' ' ' LYS . 63.0 t -116.44 111.94 41.67 Favored Pre-proline 0 N--CA 1.494 1.742 0 O-C-N 121.201 -0.937 . . . . 0.0 109.698 179.693 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.04 140.96 32.15 Favored 'Trans proline' 0 N--CA 1.485 0.981 0 O-C-N 123.123 1.065 . . . . 0.0 110.452 -179.843 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -103.69 150.89 38.6 Favored Pre-proline 0 N--CA 1.498 1.944 0 O-C-N 121.178 -0.951 . . . . 0.0 110.138 179.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -72.92 70.95 3.52 Favored 'Trans proline' 0 C--N 1.317 -1.118 0 O-C-N 123.389 1.204 . . . . 0.0 110.277 179.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 58.4 t80 -147.07 -58.94 0.28 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.161 -0.962 . . . . 0.0 110.418 -179.935 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 3.3 t -113.96 156.04 24.75 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.123 -0.986 . . . . 0.0 110.247 179.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -102.36 -49.35 3.9 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.24 -0.913 . . . . 0.0 110.182 179.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.9 t -60.39 -40.43 90.85 Favored 'General case' 0 N--CA 1.509 2.494 0 O-C-N 121.205 -0.934 . . . . 0.0 110.049 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -133.46 -155.17 7.63 Favored Glycine 0 N--CA 1.494 2.514 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 94.31 68.94 1.06 Allowed Glycine 0 N--CA 1.492 2.409 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -143.13 143.64 31.9 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.168 -1.195 . . . . 0.0 110.227 179.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 10.1 ttp -114.85 124.15 51.0 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.208 -0.932 . . . . 0.0 110.25 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.462 ' HB2' HG22 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -138.08 123.09 19.06 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.198 -0.939 . . . . 0.0 110.178 -179.963 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' A' ' 19' ' ' LYS . 23.5 mt-10 -120.63 156.41 31.74 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.092 -1.005 . . . . 0.0 109.818 179.517 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.604 ' O ' HD11 ' A' ' 25' ' ' ILE . 64.8 m95 -100.53 118.63 37.1 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.086 -1.009 . . . . 0.0 110.562 -179.823 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.473 ' OH ' ' CB ' ' A' ' 34' ' ' LYS . 0.2 OUTLIER -132.58 163.26 29.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.182 -0.949 . . . . 0.0 110.282 178.301 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -58.5 -172.29 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.394 0 O-C-N 121.421 -0.8 . . . . 0.0 109.749 -179.274 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.511 HG22 ' ND1' ' A' ' 93' ' ' HIS . 41.3 mm -88.12 -50.8 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.097 -1.002 . . . . 0.0 109.118 179.448 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.6 tttp -56.37 -28.33 58.85 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.347 -0.846 . . . . 0.0 110.803 179.464 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 70.9 m -65.07 -39.08 92.73 Favored 'General case' 0 N--CA 1.508 2.451 0 O-C-N 120.856 -1.152 . . . . 0.0 110.251 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.2 tpt -80.31 -40.64 26.4 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 121.144 -0.973 . . . . 0.0 109.195 178.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 -70.47 -29.29 65.81 Favored 'General case' 0 N--CA 1.504 2.246 0 C-N-CA 119.369 -0.933 . . . . 0.0 109.901 178.526 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -65.96 -38.1 87.71 Favored 'General case' 0 N--CA 1.507 2.381 0 O-C-N 120.918 -1.114 . . . . 0.0 109.458 179.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -58.08 -37.79 75.15 Favored 'General case' 0 N--CA 1.511 2.586 0 O-C-N 121.116 -0.99 . . . . 0.0 109.938 179.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.453 ' N ' HD12 ' A' ' 60' ' ' LEU . 11.0 mp -69.34 -41.56 76.47 Favored 'General case' 0 N--CA 1.507 2.395 0 O-C-N 121.247 -0.908 . . . . 0.0 109.519 179.484 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.756 ' HG2' HD11 ' A' ' 97' ' ' LEU . 2.8 mm-40 -68.29 -34.56 76.39 Favored 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.267 -0.896 . . . . 0.0 110.234 179.465 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.22 -37.09 33.81 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 121.065 -1.022 . . . . 0.0 110.284 179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -128.3 142.63 51.08 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.013 -1.054 . . . . 0.0 110.093 179.953 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.71 101.56 9.19 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.164 -0.96 . . . . 0.0 110.216 179.93 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.428 ' O ' HG23 ' A' ' 67' ' ' THR . . . -89.95 3.46 53.04 Favored 'General case' 0 N--CA 1.505 2.297 0 O-C-N 121.222 -0.924 . . . . 0.0 112.011 179.497 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 55.56 36.76 27.82 Favored 'General case' 0 N--CA 1.503 2.176 0 O-C-N 120.381 -1.449 . . . . 0.0 110.45 -179.299 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 65' ' ' ALA . 20.6 p -117.45 161.76 19.06 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.205 -0.934 . . . . 0.0 109.946 179.894 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.1 mmtp -97.45 95.38 7.61 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.172 -0.955 . . . . 0.0 109.971 179.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.8 mtmm -116.89 132.28 56.74 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.217 -0.927 . . . . 0.0 110.176 -179.979 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.734 HG23 HD11 ' A' ' 76' ' ' LEU . 79.5 mt 52.93 94.86 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 120.982 -1.074 . . . . 0.0 110.596 -179.95 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -113.04 133.64 54.88 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.193 -0.942 . . . . 0.0 109.837 179.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t70 52.7 -163.91 0.08 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.002 -1.061 . . . . 0.0 110.466 -179.777 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.713 HD22 ' OG1' ' A' ' 91' ' ' THR . 17.0 tp -110.64 -59.5 1.94 Allowed 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.7 81.96 0.1 Allowed 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.131 -0.981 . . . . 0.0 109.343 179.758 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -166.27 -53.42 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.329 -0.857 . . . . 0.0 110.647 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.777 HD22 ' HB3' ' A' ' 6' ' ' PHE . 94.9 mt -62.38 150.94 38.28 Favored 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.262 -0.899 . . . . 0.0 109.462 179.568 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -78.8 118.23 20.66 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 121.137 -0.977 . . . . 0.0 110.516 -179.607 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 147.65 -41.04 0.95 Allowed Glycine 0 N--CA 1.492 2.406 0 C-N-CA 119.646 -1.264 . . . . 0.0 110.942 179.313 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.416 ' CE3' ' HA ' ' A' ' 80' ' ' GLU . 30.1 p-90 -57.62 -28.78 63.98 Favored 'General case' 0 N--CA 1.512 2.669 0 CA-C-N 118.838 1.319 . . . . 0.0 111.157 -179.344 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.416 ' HA ' ' CE3' ' A' ' 79' ' ' TRP . 4.1 tp10 -53.66 -27.63 28.6 Favored 'General case' 0 N--CA 1.511 2.599 0 O-C-N 120.819 -1.176 . . . . 0.0 111.462 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -109.42 24.33 13.24 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.717 -1.239 . . . . 0.0 112.302 -179.342 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.676 HD22 ' HB2' ' A' ' 10' ' ' TYR . 23.8 mt -111.79 -163.33 0.84 Allowed 'General case' 0 N--CA 1.497 1.89 0 O-C-N 120.701 -1.249 . . . . 0.0 109.5 179.283 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -99.64 162.02 13.26 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.93 -1.106 . . . . 0.0 110.47 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.11 -46.98 26.19 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.263 -0.898 . . . . 0.0 110.08 179.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -61.52 -46.16 91.14 Favored 'General case' 0 N--CA 1.51 2.538 0 O-C-N 121.24 -0.913 . . . . 0.0 109.426 179.753 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.452 ' CG ' ' OH ' ' A' ' 10' ' ' TYR . 23.1 mt-10 -62.15 -39.91 94.21 Favored 'General case' 0 N--CA 1.507 2.383 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.274 179.095 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.623 ' HA ' HD12 ' A' ' 90' ' ' ILE . 13.6 mtmt -56.0 -37.97 69.84 Favored 'General case' 0 N--CA 1.51 2.569 0 O-C-N 121.201 -0.937 . . . . 0.0 109.763 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -57.41 -38.67 74.68 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.224 -0.923 . . . . 0.0 109.879 179.299 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -59.65 -40.73 88.65 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.124 -0.985 . . . . 0.0 109.88 179.634 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' A' ' 87' ' ' LYS . 19.2 mt -65.61 -38.29 82.01 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.44 0 O-C-N 121.317 -0.864 . . . . 0.0 109.399 179.312 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.713 ' OG1' HD22 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -60.52 -38.51 84.64 Favored 'General case' 0 N--CA 1.508 2.432 0 O-C-N 120.989 -1.069 . . . . 0.0 109.497 179.042 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -56.82 -38.14 72.18 Favored 'General case' 0 N--CA 1.51 2.541 0 O-C-N 121.224 -0.923 . . . . 0.0 109.873 179.213 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.511 ' ND1' HG22 ' A' ' 53' ' ' ILE . 2.7 m-70 -56.32 -51.39 68.39 Favored 'General case' 0 N--CA 1.511 2.606 0 O-C-N 121.092 -1.005 . . . . 0.0 109.777 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.412 HD12 ' O ' ' A' ' 90' ' ' ILE . 2.9 mp -62.29 -38.77 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.442 0 O-C-N 121.256 -0.903 . . . . 0.0 109.324 179.524 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.58 -40.95 89.17 Favored 'General case' 0 N--CA 1.506 2.373 0 O-C-N 121.204 -0.935 . . . . 0.0 109.526 179.425 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -63.19 -41.83 99.25 Favored 'General case' 0 N--CA 1.508 2.464 0 C-N-CA 119.381 -0.928 . . . . 0.0 109.059 179.177 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.756 HD11 ' HG2' ' A' ' 61' ' ' GLU . 2.3 tp -76.26 -35.03 59.14 Favored 'General case' 0 N--CA 1.505 2.281 0 O-C-N 121.338 -0.851 . . . . 0.0 109.695 178.875 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 29.4 m -106.44 66.85 0.71 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.053 -1.029 . . . . 0.0 110.041 179.626 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -100.01 167.27 10.59 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.06 -1.025 . . . . 0.0 110.052 179.765 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 7.2 mmtp -116.95 -177.79 3.28 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.221 -0.924 . . . . 0.0 110.458 -179.79 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -126.54 -163.69 1.26 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.315 -0.866 . . . . 0.0 110.006 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -109.59 93.46 4.52 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.134 -0.979 . . . . 0.0 110.148 179.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 98.03 137.57 9.75 Favored Glycine 0 N--CA 1.493 2.493 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 7.3 t -140.98 147.55 48.36 Favored Pre-proline 0 N--CA 1.496 1.843 0 O-C-N 121.167 -1.196 . . . . 0.0 110.249 179.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -74.14 -44.27 0.46 Allowed 'Trans proline' 0 C--N 1.317 -1.091 0 O-C-N 123.343 1.181 . . . . 0.0 110.538 -179.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 18.5 pttt -147.63 -172.75 4.11 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.209 -0.932 . . . . 0.0 110.512 -179.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 39.5 tttt -140.15 114.07 8.89 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.272 -0.892 . . . . 0.0 110.123 -179.981 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -126.29 48.36 2.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.154 -0.966 . . . . 0.0 110.212 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -128.8 107.65 9.82 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.17 -0.956 . . . . 0.0 110.21 -179.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.5 t -117.23 132.11 67.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.221 -0.925 . . . . 0.0 109.941 -179.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -126.25 125.64 68.02 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.243 -0.911 . . . . 0.0 110.009 179.945 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.1 mt-30 -129.14 145.92 51.19 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.25 -0.907 . . . . 0.0 110.279 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -128.48 107.28 9.6 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.251 -0.905 . . . . 0.0 110.249 -179.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -119.4 99.71 6.85 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.224 -0.922 . . . . 0.0 110.215 179.952 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 7.6 tp -119.99 146.8 45.52 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.237 -0.915 . . . . 0.0 110.272 179.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 1.3 p -133.09 139.31 47.07 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.195 -0.94 . . . . 0.0 110.222 -179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 39.1 p . . . . . 0 N--CA 1.494 1.731 0 CA-C-O 118.051 -0.976 . . . . 0.0 110.199 179.976 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 ttp . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 120.7 0.286 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -124.91 178.71 5.36 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.182 -0.949 . . . . 0.0 110.206 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -126.6 -59.91 1.27 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.227 -0.921 . . . . 0.0 110.163 -180.0 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -135.05 143.93 46.99 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.314 -0.866 . . . . 0.0 110.201 179.985 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.1 mtt-85 -115.97 152.47 33.42 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.195 -0.94 . . . . 0.0 110.301 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.535 ' CD1' HD11 ' A' ' 70' ' ' ILE . 0.6 OUTLIER -144.93 135.59 24.5 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.375 -0.828 . . . . 0.0 109.781 -179.894 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.487 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.8 m -153.24 165.56 35.33 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.11 -0.994 . . . . 0.0 110.059 179.227 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.577 HG13 ' HB2' ' A' ' 77' ' ' GLU . 10.2 m -100.75 120.33 50.1 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.052 -1.03 . . . . 0.0 110.224 179.451 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.437 ' HB2' ' CZ3' ' A' ' 50' ' ' TRP . 0.6 OUTLIER -115.15 99.29 7.32 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.102 -0.999 . . . . 0.0 110.099 179.838 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.684 ' CD2' HD13 ' A' ' 82' ' ' LEU . 40.3 m-85 -52.61 156.16 1.97 Allowed 'General case' 0 N--CA 1.514 2.745 0 O-C-N 121.144 -0.973 . . . . 0.0 110.427 -179.893 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.443 ' HB2' ' CG2' ' A' ' 25' ' ' ILE . . . -93.26 112.66 24.65 Favored 'General case' 0 N--CA 1.502 2.175 0 O-C-N 121.39 -0.819 . . . . 0.0 110.332 -179.858 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -148.12 38.99 0.91 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.309 -0.87 . . . . 0.0 110.416 179.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 ttp85 -151.52 39.42 0.65 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.15 -0.969 . . . . 0.0 110.595 -179.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 110.84 -171.43 14.52 Favored Glycine 0 N--CA 1.492 2.43 0 N-CA-C 109.581 -1.407 . . . . 0.0 109.581 179.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.567 HG23 HG22 ' A' ' 26' ' ' VAL . 61.2 m -117.59 142.85 46.72 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -1.209 . . . . 0.0 110.251 179.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.0 140.0 25.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.998 . . . . 0.0 110.91 -179.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.19 140.58 44.81 Favored Glycine 0 N--CA 1.495 2.598 0 N-CA-C 108.614 -1.795 . . . . 0.0 108.614 179.254 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.493 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 21.1 p -80.65 125.32 29.87 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.096 -1.238 . . . . 0.0 111.081 -178.882 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.472 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -73.2 156.99 38.0 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 179.839 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.54 16.15 10.37 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 120.813 -1.18 . . . . 0.0 111.411 -178.68 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.0 p -176.46 152.37 1.06 Allowed 'General case' 0 N--CA 1.504 2.258 0 O-C-N 120.528 -1.357 . . . . 0.0 110.589 177.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 12.3 tptm -88.91 91.42 8.82 Favored 'General case' 0 N--CA 1.512 2.663 0 O-C-N 120.969 -1.082 . . . . 0.0 111.598 -178.065 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.428 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 1.9 tt0 -168.35 -174.41 2.25 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.247 -0.908 . . . . 0.0 110.577 179.157 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.5 mttp -128.49 152.76 47.89 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.001 -1.062 . . . . 0.0 109.709 179.825 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.584 HD13 ' HD3' ' A' ' 31' ' ' ARG . 61.3 mt -107.75 98.85 7.5 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.222 -0.924 . . . . 0.0 109.959 -179.982 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.64 ' O ' HG12 ' A' ' 29' ' ' VAL . 60.1 t -105.08 160.58 5.2 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.33 -0.856 . . . . 0.0 110.006 179.815 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 45.5 mttp -48.28 134.23 14.87 Favored 'General case' 0 N--CA 1.515 2.778 0 O-C-N 121.442 -0.786 . . . . 0.0 111.085 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 103.18 6.67 44.87 Favored Glycine 0 N--CA 1.495 2.58 0 C-N-CA 120.176 -1.011 . . . . 0.0 111.496 -179.734 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.64 HG12 ' O ' ' A' ' 26' ' ' VAL . 9.4 p -125.59 137.49 57.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 CA-C-N 119.681 1.741 . . . . 0.0 110.45 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 20.0 t -92.19 136.35 33.25 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.181 -0.949 . . . . 0.0 110.074 179.947 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.584 ' HD3' HD13 ' A' ' 25' ' ' ILE . 5.9 ptt-85 -135.27 149.14 49.75 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.278 -0.889 . . . . 0.0 110.077 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.487 HG23 ' O ' ' A' ' 7' ' ' CYS . 15.6 mt -110.18 126.68 67.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 O-C-N 121.181 -0.949 . . . . 0.0 109.784 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.419 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.75 145.16 15.89 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 108.677 -1.769 . . . . 0.0 108.677 179.375 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 28.2 ttpt -111.95 125.08 53.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.192 -1.181 . . . . 0.0 109.057 179.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.487 HG22 ' HB3' ' A' ' 48' ' ' LYS . 59.7 t -100.26 109.58 25.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 O-C-N 121.072 -1.018 . . . . 0.0 110.506 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.59 134.89 24.72 Favored Pre-proline 0 N--CA 1.495 1.823 0 O-C-N 121.205 -0.934 . . . . 0.0 109.818 179.637 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.24 127.78 11.54 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 O-C-N 123.107 1.056 . . . . 0.0 110.207 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -104.05 116.79 60.95 Favored Pre-proline 0 N--CA 1.498 1.97 0 O-C-N 121.146 -0.971 . . . . 0.0 110.186 179.813 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.93 80.84 2.32 Favored 'Trans proline' 0 C--N 1.32 -0.957 0 O-C-N 123.177 1.093 . . . . 0.0 110.312 179.788 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -145.68 -58.86 0.33 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.191 -0.943 . . . . 0.0 110.433 -179.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.24 157.28 19.61 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.133 -0.979 . . . . 0.0 110.256 -179.867 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -96.23 -39.49 9.64 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.224 -0.923 . . . . 0.0 110.422 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 m -56.9 -39.75 75.01 Favored 'General case' 0 N--CA 1.511 2.575 0 O-C-N 121.01 -1.056 . . . . 0.0 110.186 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -77.59 -178.71 48.59 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.48 -1.448 . . . . 0.0 109.48 179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -140.39 -88.36 0.15 Allowed Glycine 0 N--CA 1.494 2.535 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 179.951 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -116.5 150.52 37.78 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.258 -1.143 . . . . 0.0 110.224 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.3 mtt -111.99 147.39 36.04 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.234 -0.916 . . . . 0.0 110.203 179.945 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.487 ' HB3' HG22 ' A' ' 35' ' ' VAL . 5.0 ptpt -143.3 134.61 26.0 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.206 -0.934 . . . . 0.0 110.271 -179.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -112.15 159.57 18.41 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.242 -0.911 . . . . 0.0 109.499 179.754 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CZ3' ' HB2' ' A' ' 9' ' ' ASP . 9.1 m95 -110.7 113.77 26.63 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.024 -1.047 . . . . 0.0 111.311 -179.729 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.528 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 0.4 OUTLIER -126.13 170.07 12.17 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 119.428 -0.909 . . . . 0.0 109.27 177.205 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.493 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 68.1 m80 -89.21 161.32 16.5 Favored 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 119.836 -0.746 . . . . 0.0 110.463 -179.877 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.483 HG22 ' ND1' ' A' ' 93' ' ' HIS . 27.9 mt -65.53 -47.14 87.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 C-N-CA 118.987 -1.085 . . . . 0.0 108.078 178.405 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.2 tttt -61.42 -40.73 95.49 Favored 'General case' 0 N--CA 1.508 2.431 0 C-N-CA 119.279 -0.968 . . . . 0.0 109.214 178.609 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 33.3 m -63.92 -43.71 95.1 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.316 -0.865 . . . . 0.0 109.013 178.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.406 ' HG3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -73.34 -45.58 54.28 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 121.431 -0.793 . . . . 0.0 109.775 179.938 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.467 ' CE2' HG23 ' A' ' 53' ' ' ILE . 10.6 m-85 -65.48 -28.81 69.47 Favored 'General case' 0 N--CA 1.504 2.233 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.618 179.033 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -64.47 -41.99 96.17 Favored 'General case' 0 N--CA 1.504 2.272 0 O-C-N 120.831 -1.168 . . . . 0.0 109.034 178.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 8.1 tptt -72.56 -41.44 65.76 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.375 -0.93 . . . . 0.0 108.702 178.399 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.06 -39.95 94.11 Favored 'General case' 0 N--CA 1.507 2.38 0 C-N-CA 119.529 -0.868 . . . . 0.0 108.857 178.62 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.05 -32.3 66.06 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 121.128 -0.982 . . . . 0.0 109.663 178.435 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 11.3 mmm-85 -102.36 28.82 5.61 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.174 -0.954 . . . . 0.0 110.749 179.219 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -110.73 167.32 10.32 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 120.794 -1.191 . . . . 0.0 110.356 179.837 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -66.68 157.78 31.75 Favored 'General case' 0 N--CA 1.507 2.412 0 O-C-N 121.17 -0.956 . . . . 0.0 110.152 -179.876 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -80.2 -34.34 37.45 Favored 'General case' 0 N--CA 1.508 2.434 0 O-C-N 121.212 -0.93 . . . . 0.0 110.7 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 25.3 m -51.22 -34.42 32.02 Favored 'General case' 0 N--CA 1.514 2.773 0 O-C-N 120.96 -1.088 . . . . 0.0 110.941 -179.863 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 1.8 m -109.65 102.35 11.18 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.07 -1.019 . . . . 0.0 110.242 179.82 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -115.9 144.85 43.47 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.202 -0.937 . . . . 0.0 109.962 179.95 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.0 mttp -125.7 149.38 48.54 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.133 -0.98 . . . . 0.0 110.605 -179.701 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.535 HD11 ' CD1' ' A' ' 6' ' ' PHE . 78.4 mt 54.35 101.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.029 0 O-C-N 121.258 -0.901 . . . . 0.0 111.093 179.851 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -112.22 146.65 37.77 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.319 -0.863 . . . . 0.0 109.014 178.826 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 t0 53.81 -161.7 0.12 Allowed 'General case' 0 N--CA 1.502 2.151 0 O-C-N 120.922 -1.111 . . . . 0.0 110.148 -179.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.75 HD21 ' HG2' ' A' ' 87' ' ' LYS . 4.8 tp -112.54 -60.0 1.93 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.952 -1.092 . . . . 0.0 110.614 -179.812 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.553 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -72.72 73.36 1.08 Allowed 'General case' 0 N--CA 1.508 2.474 0 O-C-N 121.162 -0.962 . . . . 0.0 109.925 -179.749 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.479 ' CB ' HD23 ' A' ' 76' ' ' LEU . 2.8 mt-10 -129.15 -58.35 1.14 Allowed 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.19 -0.944 . . . . 0.0 110.309 179.918 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.647 HD23 ' N ' ' A' ' 76' ' ' LEU . 1.3 pt? -147.87 63.83 1.12 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.968 -1.083 . . . . 0.0 110.796 179.418 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.577 ' HB2' HG13 ' A' ' 8' ' ' VAL . 8.7 pt-20 -144.42 140.2 28.85 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.01 -1.056 . . . . 0.0 110.266 178.299 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.611 ' O ' HD12 ' A' ' 82' ' ' LEU . . . -72.59 69.01 1.2 Allowed Glycine 0 N--CA 1.498 2.814 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.763 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.553 ' CE2' HG22 ' A' ' 74' ' ' THR . 59.5 p-90 -92.49 -36.25 13.17 Favored 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.118 -1.224 . . . . 0.0 110.805 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -53.17 -28.92 28.86 Favored 'General case' 0 N--CA 1.512 2.667 0 O-C-N 121.057 -1.027 . . . . 0.0 111.363 -179.74 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.8 tt0 -96.38 -34.88 11.38 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.889 -1.132 . . . . 0.0 111.18 -179.603 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.684 HD13 ' CD2' ' A' ' 10' ' ' TYR . 61.3 mt -74.7 -173.8 1.94 Allowed 'General case' 0 N--CA 1.508 2.453 0 O-C-N 120.956 -1.09 . . . . 0.0 110.256 -179.701 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -62.3 152.67 33.06 Favored 'General case' 0 N--CA 1.51 2.555 0 O-C-N 121.193 -0.942 . . . . 0.0 110.71 -179.399 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -89.78 -39.2 13.27 Favored 'General case' 0 N--CA 1.504 2.25 0 O-C-N 121.237 -0.914 . . . . 0.0 110.437 179.661 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -57.89 -44.25 86.59 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.046 -1.033 . . . . 0.0 109.971 -179.882 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.454 ' HB3' ' OH ' ' A' ' 10' ' ' TYR . 9.3 mt-10 -60.52 -39.81 89.17 Favored 'General case' 0 N--CA 1.508 2.467 0 C-N-CA 119.499 -0.88 . . . . 0.0 109.444 179.175 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.75 ' HG2' HD21 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -55.78 -38.19 69.57 Favored 'General case' 0 N--CA 1.511 2.58 0 O-C-N 121.216 -0.928 . . . . 0.0 109.904 179.182 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.44 -41.66 90.15 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.22 -0.925 . . . . 0.0 109.865 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -61.45 -32.7 72.69 Favored 'General case' 0 N--CA 1.509 2.515 0 O-C-N 121.267 -0.896 . . . . 0.0 110.656 179.858 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.61 ' HB ' HD11 ' A' ' 73' ' ' LEU . 97.2 mt -65.12 -39.0 84.11 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.527 0 O-C-N 120.979 -1.076 . . . . 0.0 109.675 179.839 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.639 ' OG1' HD22 ' A' ' 73' ' ' LEU . 41.6 m -59.01 -39.09 80.82 Favored 'General case' 0 N--CA 1.509 2.513 0 O-C-N 120.964 -1.085 . . . . 0.0 109.892 179.649 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -56.32 -37.28 69.72 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.203 -0.936 . . . . 0.0 109.975 179.374 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.483 ' ND1' HG22 ' A' ' 53' ' ' ILE . 2.5 m-70 -57.46 -51.96 67.32 Favored 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.085 -1.01 . . . . 0.0 110.008 179.714 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.3 mp -64.24 -38.62 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.412 0 C-N-CA 119.356 -0.938 . . . . 0.0 109.31 179.642 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.1 -37.66 81.43 Favored 'General case' 0 N--CA 1.506 2.35 0 O-C-N 121.203 -0.935 . . . . 0.0 109.741 179.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -66.57 -39.55 88.52 Favored 'General case' 0 N--CA 1.507 2.409 0 O-C-N 121.179 -0.951 . . . . 0.0 109.873 179.541 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -74.31 -34.73 63.57 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.204 -0.935 . . . . 0.0 110.281 179.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 74.8 m -96.53 58.09 1.69 Allowed 'General case' 0 N--CA 1.502 2.156 0 O-C-N 121.027 -1.045 . . . . 0.0 110.094 179.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 90.9 p -136.34 39.77 2.67 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.131 -0.981 . . . . 0.0 110.253 179.934 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -140.45 99.92 3.76 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.116 -0.99 . . . . 0.0 110.212 -179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . 52.69 81.22 0.09 Allowed 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.014 -1.054 . . . . 0.0 110.918 -179.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -119.19 -172.19 2.26 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.189 -0.945 . . . . 0.0 110.201 -179.987 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -107.58 156.58 15.83 Favored Glycine 0 N--CA 1.493 2.461 0 N-CA-C 109.52 -1.432 . . . . 0.0 109.52 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 19.5 p -141.04 94.86 7.72 Favored Pre-proline 0 N--CA 1.494 1.737 0 O-C-N 121.19 -1.182 . . . . 0.0 110.237 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -72.81 76.38 2.47 Favored 'Trans proline' 0 C--N 1.317 -1.11 0 O-C-N 123.425 1.224 . . . . 0.0 110.377 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -140.6 93.54 2.62 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.15 -0.969 . . . . 0.0 110.182 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -119.13 144.7 46.49 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.252 -0.905 . . . . 0.0 110.269 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -117.96 127.09 53.49 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.19 -0.944 . . . . 0.0 110.174 -179.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -120.74 167.01 12.93 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.183 -0.948 . . . . 0.0 110.195 -179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.74 127.15 73.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.789 0 O-C-N 121.21 -0.931 . . . . 0.0 109.913 179.938 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.7 t -115.94 120.71 65.61 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.151 -0.968 . . . . 0.0 110.087 -179.965 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 57.2 mm-40 -117.03 128.29 55.02 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.21 -0.931 . . . . 0.0 110.142 179.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -117.53 136.35 53.31 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.187 -0.945 . . . . 0.0 110.311 -179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -121.47 128.33 52.0 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.24 -0.912 . . . . 0.0 110.13 179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.88 152.89 32.53 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.187 -0.946 . . . . 0.0 110.157 -179.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 24.2 m -117.4 131.66 56.72 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.187 -0.946 . . . . 0.0 110.23 -179.939 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.168 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 mtt . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 110.265 -0.272 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -140.83 123.19 15.87 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.142 -0.974 . . . . 0.0 110.28 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.7 mp0 -136.24 145.25 45.41 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.178 -0.951 . . . . 0.0 110.227 -179.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.1 mp0 -138.08 133.59 33.66 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.146 -0.971 . . . . 0.0 110.215 179.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -116.99 151.51 36.58 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.25 -0.906 . . . . 0.0 110.215 -179.943 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.731 ' O ' HD12 ' A' ' 76' ' ' LEU . 1.1 m-85 -149.27 136.45 19.93 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 121.304 -0.873 . . . . 0.0 110.205 -179.65 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' ILE . 26.2 p -151.93 157.66 42.1 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.227 -0.921 . . . . 0.0 109.807 178.735 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.753 HG22 ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -102.3 141.44 18.47 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.244 0 O-C-N 120.834 -1.166 . . . . 0.0 110.798 179.869 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -141.97 148.24 38.27 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.269 -0.894 . . . . 0.0 109.607 179.495 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.443 ' CD2' HD11 ' A' ' 82' ' ' LEU . 0.3 OUTLIER -96.02 151.61 19.29 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.085 -1.01 . . . . 0.0 109.873 179.917 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.74 ' HB2' ' HD2' ' A' ' 31' ' ' ARG . . . -92.95 147.14 23.09 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.289 -0.882 . . . . 0.0 110.546 -179.578 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 14.0 mmtp -120.1 -57.83 1.91 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.29 -0.881 . . . . 0.0 110.056 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.3 ttm-85 -139.29 132.54 29.88 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.184 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 115.15 164.67 14.49 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.654 -1.378 . . . . 0.0 109.654 179.898 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 20.9 m -135.0 143.71 46.97 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.23 -1.159 . . . . 0.0 110.258 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -141.32 143.82 34.26 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.222 -0.924 . . . . 0.0 110.884 -179.85 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -72.05 127.87 13.46 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -63.09 130.39 44.45 Favored 'General case' 0 N--CA 1.509 2.51 0 O-C-N 121.358 -1.084 . . . . 0.0 109.381 179.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.443 ' HB3' ' CE2' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -61.92 147.86 45.45 Favored 'General case' 0 N--CA 1.509 2.518 0 O-C-N 121.178 -0.951 . . . . 0.0 109.212 179.793 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 64.6 mttt 52.6 45.41 28.67 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.905 -1.122 . . . . 0.0 109.591 -179.126 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 31.6 t -164.89 144.72 7.14 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.386 -0.821 . . . . 0.0 110.769 -178.156 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -97.75 56.71 1.29 Allowed 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 178.397 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -145.63 -172.05 3.81 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.374 -0.829 . . . . 0.0 110.238 -178.482 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.4 mtmt -135.31 159.29 42.04 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.193 -0.942 . . . . 0.0 109.629 -179.6 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.684 HG21 ' HG2' ' A' ' 31' ' ' ARG . 74.3 mt -107.92 119.36 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 O-C-N 121.41 -0.806 . . . . 0.0 110.057 -179.781 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.686 ' O ' HG12 ' A' ' 29' ' ' VAL . 32.4 m -118.7 166.2 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 O-C-N 121.202 -0.936 . . . . 0.0 110.584 -179.845 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.8 tttt -48.13 143.28 4.57 Favored 'General case' 0 N--CA 1.515 2.784 0 O-C-N 121.512 -0.742 . . . . 0.0 111.023 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 96.3 5.83 59.07 Favored Glycine 0 N--CA 1.494 2.541 0 C-N-CA 120.15 -1.024 . . . . 0.0 111.239 -179.362 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 26' ' ' VAL . 7.1 p -126.89 133.63 68.02 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 CA-C-N 119.545 1.673 . . . . 0.0 109.977 179.796 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.657 ' HB3' HD11 ' A' ' 53' ' ' ILE . 43.2 t -81.13 139.31 35.69 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.052 -1.03 . . . . 0.0 109.341 179.663 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.74 ' HD2' ' HB2' ' A' ' 11' ' ' ALA . 7.8 mtp180 -124.21 142.9 50.85 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.176 -0.952 . . . . 0.0 110.697 -178.731 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.548 HD12 ' HG2' ' A' ' 56' ' ' MET . 22.9 mt -96.74 129.01 47.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 O-C-N 121.105 -0.997 . . . . 0.0 109.375 178.722 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -100.9 122.72 7.7 Favored Glycine 0 N--CA 1.489 2.18 0 N-CA-C 108.752 -1.739 . . . . 0.0 108.752 179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.432 ' HB2' ' CE1' ' A' ' 6' ' ' PHE . 58.4 tttt -106.25 122.07 45.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.217 -1.166 . . . . 0.0 109.703 -179.79 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.1 t -101.0 115.54 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 121.107 -0.996 . . . . 0.0 110.361 -179.767 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 65.2 t -120.73 111.67 34.33 Favored Pre-proline 0 N--CA 1.495 1.788 0 O-C-N 121.214 -0.929 . . . . 0.0 109.762 179.826 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.08 131.01 14.91 Favored 'Trans proline' 0 N--CA 1.485 1.0 0 O-C-N 123.131 1.069 . . . . 0.0 110.431 -179.998 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 83.4 m-20 -103.98 117.13 60.34 Favored Pre-proline 0 N--CA 1.501 2.076 0 O-C-N 121.231 -0.918 . . . . 0.0 110.035 179.734 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.53 70.62 4.87 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 O-C-N 123.207 1.109 . . . . 0.0 110.39 179.813 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.484 ' HD2' ' HG ' ' A' ' 41' ' ' SER . 84.6 t80 -147.67 -59.14 0.26 Allowed 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.071 -1.018 . . . . 0.0 110.482 -179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.484 ' HG ' ' HD2' ' A' ' 40' ' ' PHE . 65.9 m -109.42 157.94 18.43 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.157 -0.964 . . . . 0.0 110.278 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -94.58 -38.89 10.65 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 121.291 -0.881 . . . . 0.0 110.331 179.854 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.26 -40.07 76.9 Favored 'General case' 0 N--CA 1.511 2.59 0 O-C-N 121.051 -1.03 . . . . 0.0 110.118 179.914 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -95.43 84.28 0.9 Allowed Glycine 0 N--CA 1.493 2.44 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.85 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.69 -74.1 0.43 Allowed Glycine 0 N--CA 1.492 2.419 0 N-CA-C 109.824 -1.31 . . . . 0.0 109.824 -179.807 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -133.47 151.17 51.75 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.216 -1.167 . . . . 0.0 110.466 -179.894 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 2.3 ttt -110.91 142.8 42.49 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.337 -0.852 . . . . 0.0 110.019 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.428 ' HD3' ' CH2' ' A' ' 50' ' ' TRP . 0.1 OUTLIER -119.6 124.84 47.34 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.166 -0.959 . . . . 0.0 110.328 -179.769 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -112.15 146.88 37.26 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.142 -0.974 . . . . 0.0 109.627 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.428 ' CH2' ' HD3' ' A' ' 48' ' ' LYS . 18.0 m95 -98.88 128.17 44.99 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.181 -0.95 . . . . 0.0 110.281 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.443 ' CE2' ' HB3' ' A' ' 19' ' ' LYS . 86.9 m-85 -111.56 172.8 6.68 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.319 -0.863 . . . . 0.0 110.278 179.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 2.1 m80 -90.25 -173.09 3.7 Favored 'General case' 0 N--CA 1.504 2.231 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.534 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.891 HG22 ' CE1' ' A' ' 93' ' ' HIS . 40.5 mm -87.28 -38.92 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.263 0 O-C-N 121.005 -1.06 . . . . 0.0 109.332 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -88.13 -29.33 20.66 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 120.73 -1.231 . . . . 0.0 110.915 179.116 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 74.6 m -65.9 -51.66 56.71 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 120.835 -1.166 . . . . 0.0 110.487 -179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.548 ' HG2' HD12 ' A' ' 32' ' ' ILE . 10.6 tpt -66.59 -39.75 88.56 Favored 'General case' 0 N--CA 1.507 2.422 0 C-N-CA 119.488 -0.885 . . . . 0.0 110.178 -179.509 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.458 ' HD1' HD22 ' A' ' 97' ' ' LEU . 6.7 m-85 -72.87 -30.56 64.08 Favored 'General case' 0 N--CA 1.504 2.251 0 C-N-CA 119.115 -1.034 . . . . 0.0 109.792 179.191 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -67.75 -36.71 81.03 Favored 'General case' 0 N--CA 1.506 2.329 0 O-C-N 120.918 -1.114 . . . . 0.0 109.639 178.784 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -39.87 86.73 Favored 'General case' 0 N--CA 1.51 2.544 0 O-C-N 121.045 -1.034 . . . . 0.0 109.82 179.533 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.0 mp -59.08 -43.39 91.8 Favored 'General case' 0 N--CA 1.51 2.539 0 O-C-N 121.201 -0.937 . . . . 0.0 109.248 179.351 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.5 ' HG3' HD11 ' A' ' 97' ' ' LEU . 3.8 mt-10 -57.82 -34.67 69.92 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.194 -0.941 . . . . 0.0 109.484 178.497 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 6.9 ttm105 -103.78 30.77 4.86 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.299 -0.876 . . . . 0.0 110.399 179.037 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -102.37 170.28 8.16 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.917 -1.115 . . . . 0.0 109.945 179.643 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 4.7 mmm180 -60.71 155.59 18.81 Favored 'General case' 0 N--CA 1.509 2.506 0 O-C-N 121.156 -0.965 . . . . 0.0 110.069 -179.678 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.79 -33.64 76.47 Favored 'General case' 0 N--CA 1.509 2.504 0 O-C-N 121.227 -0.921 . . . . 0.0 110.804 -179.79 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 41.7 p -96.96 58.26 1.58 Allowed 'General case' 0 N--CA 1.501 2.112 0 O-C-N 120.935 -1.103 . . . . 0.0 110.229 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 3.2 m -115.95 157.94 23.81 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.183 -0.948 . . . . 0.0 110.105 179.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -136.02 100.49 4.44 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.203 -0.936 . . . . 0.0 110.193 179.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.05 108.83 5.95 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.235 -0.915 . . . . 0.0 110.277 -179.876 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 78.9 mt 54.28 99.49 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.163 -0.961 . . . . 0.0 110.838 179.846 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -112.79 134.86 54.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.209 -0.932 . . . . 0.0 109.647 179.369 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 t70 53.74 -165.18 0.09 Allowed 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.964 -1.085 . . . . 0.0 110.451 -179.688 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.848 HD13 HG22 ' A' ' 91' ' ' THR . 0.3 OUTLIER -114.26 -176.97 3.02 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.103 -0.998 . . . . 0.0 110.218 179.913 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.593 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.5 OUTLIER 46.73 37.3 4.54 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 121.154 -0.966 . . . . 0.0 111.425 -179.777 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.512 ' HB3' HD23 ' A' ' 76' ' ' LEU . 3.9 mm-40 -111.45 -60.05 1.9 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.184 -0.948 . . . . 0.0 109.599 179.547 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.731 HD12 ' O ' ' A' ' 6' ' ' PHE . 1.1 pt? -143.42 62.3 1.38 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.214 -0.929 . . . . 0.0 109.772 178.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.753 ' HB2' HG22 ' A' ' 8' ' ' VAL . 12.8 pt-20 -144.92 141.26 28.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.754 -1.216 . . . . 0.0 111.002 179.348 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -73.02 70.12 1.24 Allowed Glycine 0 N--CA 1.495 2.616 0 N-CA-C 108.806 -1.718 . . . . 0.0 108.806 178.859 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.593 ' CE2' HG22 ' A' ' 74' ' ' THR . 60.7 p-90 -90.7 -23.55 20.69 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.313 -1.11 . . . . 0.0 111.787 -179.73 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -51.77 -32.0 29.15 Favored 'General case' 0 N--CA 1.514 2.756 0 O-C-N 120.702 -1.248 . . . . 0.0 110.768 179.741 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -83.48 -38.6 21.61 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 120.917 -1.115 . . . . 0.0 109.892 179.243 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.443 HD11 ' CD2' ' A' ' 10' ' ' TYR . 0.2 OUTLIER -51.76 178.63 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.84 0 O-C-N 121.062 -1.024 . . . . 0.0 110.508 -179.925 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -105.68 160.85 14.89 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.127 -0.983 . . . . 0.0 110.415 179.872 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 3.5 t70 -58.72 -39.79 81.85 Favored 'General case' 0 N--CA 1.51 2.527 0 O-C-N 121.272 -0.892 . . . . 0.0 110.403 -179.646 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -66.38 -42.41 87.99 Favored 'General case' 0 N--CA 1.507 2.398 0 O-C-N 121.249 -0.907 . . . . 0.0 109.705 179.93 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.413 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 20.3 mt-10 -66.63 -39.29 88.24 Favored 'General case' 0 N--CA 1.506 2.375 0 C-N-CA 119.513 -0.875 . . . . 0.0 109.416 179.234 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.724 ' HA ' HD12 ' A' ' 90' ' ' ILE . 16.2 ttpp -61.38 -39.08 89.35 Favored 'General case' 0 N--CA 1.507 2.413 0 O-C-N 121.252 -0.905 . . . . 0.0 109.843 179.334 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.406 ' O ' ' OG1' ' A' ' 91' ' ' THR . 13.6 tt0 -58.66 -39.21 79.97 Favored 'General case' 0 N--CA 1.51 2.529 0 O-C-N 121.165 -0.96 . . . . 0.0 110.063 179.762 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -63.8 -39.29 93.89 Favored 'General case' 0 N--CA 1.508 2.466 0 O-C-N 121.151 -0.968 . . . . 0.0 110.083 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.724 HD12 ' HA ' ' A' ' 87' ' ' LYS . 8.3 mt -67.17 -41.15 86.53 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.417 0 O-C-N 121.216 -0.928 . . . . 0.0 109.379 179.495 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.848 HG22 HD13 ' A' ' 73' ' ' LEU . 30.5 p -60.83 -38.32 85.08 Favored 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.166 -0.959 . . . . 0.0 109.802 179.437 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -57.6 -39.89 77.84 Favored 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.113 -0.992 . . . . 0.0 109.845 179.533 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.891 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.8 m-70 -60.2 -52.99 62.94 Favored 'General case' 0 N--CA 1.509 2.517 0 O-C-N 121.19 -0.943 . . . . 0.0 109.702 179.651 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.603 ' CD1' HD12 ' A' ' 73' ' ' LEU . 7.9 mt -63.28 -39.21 84.42 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.4 0 C-N-CA 119.352 -0.939 . . . . 0.0 109.414 179.46 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.02 -41.14 91.37 Favored 'General case' 0 N--CA 1.506 2.325 0 O-C-N 121.179 -0.95 . . . . 0.0 109.219 178.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -71.07 -42.6 69.19 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 121.201 -0.937 . . . . 0.0 108.703 178.731 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.5 HD11 ' HG3' ' A' ' 61' ' ' GLU . 2.5 tp -62.53 -34.11 76.25 Favored 'General case' 0 N--CA 1.506 2.369 0 O-C-N 121.323 -0.861 . . . . 0.0 109.974 178.94 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 28.4 t -96.92 52.66 1.18 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.115 -0.991 . . . . 0.0 110.165 179.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 10.8 t -133.07 116.15 15.99 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.18 -0.95 . . . . 0.0 110.142 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.91 -64.11 1.36 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.202 -0.936 . . . . 0.0 110.191 -179.885 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -117.09 136.58 52.88 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.234 -0.916 . . . . 0.0 110.238 -179.933 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -131.76 118.61 20.17 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.294 -0.879 . . . . 0.0 110.21 179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -62.46 154.23 42.21 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.444 -1.462 . . . . 0.0 109.444 -179.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 4.2 p -116.68 138.45 24.56 Favored Pre-proline 0 N--CA 1.493 1.724 0 O-C-N 121.174 -1.192 . . . . 0.0 110.121 179.993 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -74.31 153.37 45.42 Favored 'Trans proline' 0 C--N 1.318 -1.033 0 O-C-N 123.311 1.164 . . . . 0.0 110.42 -179.97 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -127.89 85.75 2.39 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.202 -0.936 . . . . 0.0 110.065 179.927 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? 52.84 60.22 3.93 Favored 'General case' 0 N--CA 1.501 2.091 0 O-C-N 121.041 -1.037 . . . . 0.0 110.644 -179.971 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 19.7 mttm -116.24 -175.58 2.78 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.22 -0.925 . . . . 0.0 110.181 -179.98 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -121.2 106.05 11.15 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.122 -0.986 . . . . 0.0 110.199 -179.986 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 59.8 t -128.35 117.72 46.05 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.104 -0.998 . . . . 0.0 109.933 179.956 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.4 t -124.66 136.16 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.171 -0.955 . . . . 0.0 109.993 -179.985 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -125.87 113.21 16.92 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.289 -0.882 . . . . 0.0 110.21 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -120.93 100.72 7.24 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.165 -0.96 . . . . 0.0 110.189 -179.983 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.81 150.93 47.43 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.246 -0.909 . . . . 0.0 110.331 179.803 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.7 mt -126.12 150.19 48.4 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.197 -0.94 . . . . 0.0 110.312 -179.889 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 40.8 p -118.79 134.48 55.11 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.187 -0.946 . . . . 0.0 110.199 179.982 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 55.6 p . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.244 -179.989 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.06 -177.98 5.07 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.258 -0.901 . . . . 0.0 110.272 -179.984 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -123.5 78.56 1.6 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.251 -0.906 . . . . 0.0 110.155 179.972 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.441 ' CB ' HG22 ' A' ' 36' ' ' VAL . 39.8 mt-30 -125.71 158.78 33.95 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.143 -0.973 . . . . 0.0 110.199 -179.96 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.7 156.67 37.24 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.179 -0.95 . . . . 0.0 110.395 -179.977 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.511 ' CE1' ' OH ' ' A' ' 51' ' ' TYR . 0.4 OUTLIER -147.34 136.63 22.54 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.423 -0.798 . . . . 0.0 109.915 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.497 ' O ' HG23 ' A' ' 32' ' ' ILE . 26.3 p -152.83 160.93 43.11 Favored 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.178 -0.951 . . . . 0.0 110.027 178.957 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.67 HG22 ' HB2' ' A' ' 77' ' ' GLU . 6.8 m -101.98 122.57 54.37 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 O-C-N 120.926 -1.109 . . . . 0.0 110.612 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -120.71 154.99 34.84 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.103 -0.998 . . . . 0.0 110.223 179.58 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.434 ' CZ ' ' HB2' ' A' ' 30' ' ' CYS . 0.1 OUTLIER -106.53 149.48 27.09 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.487 -0.758 . . . . 0.0 110.075 -179.798 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.484 ' HB2' HH11 ' A' ' 31' ' ' ARG . . . -111.16 126.29 54.69 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.244 -0.91 . . . . 0.0 110.127 179.8 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 10.9 ttmt -116.61 -56.18 2.3 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.262 -0.899 . . . . 0.0 110.277 -179.916 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 13.8 ttt-85 -117.39 93.18 4.07 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.156 -0.965 . . . . 0.0 110.307 -179.966 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 140.44 126.74 2.29 Favored Glycine 0 N--CA 1.494 2.522 0 N-CA-C 109.679 -1.368 . . . . 0.0 109.679 179.995 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.846 HG22 ' HA ' ' A' ' 26' ' ' VAL . 77.2 p -115.58 145.59 42.53 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.202 -1.175 . . . . 0.0 110.07 179.881 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -147.92 145.54 28.66 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.195 -0.941 . . . . 0.0 110.879 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.34 130.44 47.7 Favored Glycine 0 N--CA 1.495 2.621 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.546 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.442 ' HB3' ' CE1' ' A' ' 52' ' ' HIS . 31.1 p -69.6 117.13 10.82 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.28 -1.129 . . . . 0.0 111.014 -178.722 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 51' ' ' TYR . 11.8 mmtt -64.59 157.28 27.4 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 121.15 -0.969 . . . . 0.0 109.547 179.849 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 63.52 18.42 11.05 Favored 'General case' 0 N--CA 1.506 2.359 0 O-C-N 120.519 -1.363 . . . . 0.0 111.395 -178.909 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 10.2 p -175.18 143.65 0.69 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 120.576 -1.328 . . . . 0.0 110.663 178.13 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.87 84.69 7.3 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 121.017 -1.052 . . . . 0.0 111.914 -177.861 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.403 ' HB3' ' SG ' ' A' ' 18' ' ' CYS . 1.3 tt0 -163.6 -174.71 3.83 Favored 'General case' 0 N--CA 1.501 2.089 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 178.687 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.4 ttmm -129.69 156.57 44.04 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.002 -1.061 . . . . 0.0 109.983 -179.732 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.632 HG23 ' CG1' ' A' ' 29' ' ' VAL . 75.4 mt -109.14 129.53 63.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 -179.992 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.846 ' HA ' HG22 ' A' ' 15' ' ' THR . 33.3 m -125.17 160.39 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.899 0 O-C-N 121.174 -0.954 . . . . 0.0 110.238 179.873 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -46.29 134.67 8.62 Favored 'General case' 0 N--CA 1.518 2.931 0 O-C-N 121.43 -0.794 . . . . 0.0 111.452 -179.321 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.43 10.39 44.66 Favored Glycine 0 N--CA 1.494 2.533 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.386 -179.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.632 ' CG1' HG23 ' A' ' 25' ' ' ILE . 9.8 p -125.53 135.9 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 CA-C-N 119.667 1.733 . . . . 0.0 110.424 -179.85 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.434 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 45.1 t -92.24 130.28 37.98 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.192 -0.943 . . . . 0.0 109.511 179.26 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.515 ' HD2' HG21 ' A' ' 25' ' ' ILE . 0.0 OUTLIER -125.26 150.85 46.67 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.233 -0.917 . . . . 0.0 110.538 -179.693 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.497 HG23 ' O ' ' A' ' 7' ' ' CYS . 22.1 mt -101.65 129.12 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.275 -0.891 . . . . 0.0 109.644 179.747 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.438 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -104.63 129.67 9.93 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.258 -1.537 . . . . 0.0 109.258 179.967 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.484 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 11.4 ttpt -101.85 121.26 41.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.302 -1.116 . . . . 0.0 109.066 179.536 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.504 HG22 ' HG3' ' A' ' 48' ' ' LYS . 56.0 t -102.71 110.51 29.56 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.022 -1.049 . . . . 0.0 110.552 -179.446 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.441 HG22 ' CB ' ' A' ' 4' ' ' GLN . 57.5 t -121.32 112.09 33.15 Favored Pre-proline 0 N--CA 1.496 1.855 0 O-C-N 121.265 -0.897 . . . . 0.0 109.568 179.612 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -73.26 126.49 11.11 Favored 'Trans proline' 0 C--N 1.318 -1.038 0 O-C-N 123.116 1.061 . . . . 0.0 110.451 -179.941 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -105.2 115.74 61.67 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 121.252 -0.905 . . . . 0.0 110.183 179.671 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -78.2 80.87 2.88 Favored 'Trans proline' 0 C--N 1.321 -0.905 0 O-C-N 123.125 1.066 . . . . 0.0 110.299 179.66 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -152.76 -57.7 0.13 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.046 -1.034 . . . . 0.0 110.86 -179.72 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.0 p -99.55 157.86 16.15 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.106 -0.996 . . . . 0.0 110.338 -179.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -96.27 -41.72 8.52 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 121.205 -0.935 . . . . 0.0 110.317 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.0 m -56.27 -39.7 73.06 Favored 'General case' 0 N--CA 1.511 2.608 0 O-C-N 121.128 -0.982 . . . . 0.0 110.233 -179.922 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -94.97 155.33 21.48 Favored Glycine 0 N--CA 1.493 2.484 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 179.729 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -131.95 -72.81 0.1 OUTLIER Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.957 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.489 ' OD1' HG12 ' A' ' 35' ' ' VAL . 0.2 OUTLIER -114.51 148.4 37.96 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.21 -1.171 . . . . 0.0 110.105 -179.94 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.9 mtt -114.99 119.78 37.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.293 -0.879 . . . . 0.0 110.274 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.504 ' HG3' HG22 ' A' ' 35' ' ' VAL . 26.3 ttmt -116.1 127.96 55.28 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.208 -0.932 . . . . 0.0 109.988 179.829 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -114.59 124.99 53.24 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.222 -0.924 . . . . 0.0 109.945 -179.967 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.438 ' CZ3' ' HA3' ' A' ' 33' ' ' GLY . 17.6 m95 -89.01 126.69 35.53 Favored 'General case' 0 N--CA 1.504 2.239 0 O-C-N 121.187 -0.946 . . . . 0.0 110.057 179.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.511 ' OH ' ' CE1' ' A' ' 6' ' ' PHE . 1.0 OUTLIER -147.21 170.46 17.2 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.527 178.68 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.442 ' CE1' ' HB3' ' A' ' 18' ' ' CYS . 57.1 m80 -74.72 179.69 4.64 Favored 'General case' 0 N--CA 1.504 2.236 0 O-C-N 121.658 -0.651 . . . . 0.0 111.217 -178.414 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.522 HG22 ' ND1' ' A' ' 93' ' ' HIS . 33.6 mm -88.57 -48.92 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 179.044 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.2 ttmt -60.46 -38.6 84.71 Favored 'General case' 0 N--CA 1.506 2.362 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.342 179.023 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 28.1 m -61.69 -50.01 74.21 Favored 'General case' 0 N--CA 1.504 2.256 0 O-C-N 121.238 -0.914 . . . . 0.0 109.068 178.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 12.4 tpt -68.91 -45.49 70.76 Favored 'General case' 0 N--CA 1.504 2.243 0 C-N-CA 119.729 -0.789 . . . . 0.0 109.385 179.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -63.95 -30.47 71.55 Favored 'General case' 0 N--CA 1.504 2.241 0 C-N-CA 119.194 -1.002 . . . . 0.0 109.615 178.926 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -60.43 -39.79 88.74 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 120.883 -1.136 . . . . 0.0 109.62 179.143 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 7.7 tptt -65.76 -40.1 91.71 Favored 'General case' 0 N--CA 1.507 2.403 0 C-N-CA 119.361 -0.936 . . . . 0.0 109.408 179.251 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -59.83 -42.61 93.91 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 121.126 -0.984 . . . . 0.0 109.173 179.23 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.3 tt0 -58.51 -34.49 71.01 Favored 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.229 -0.92 . . . . 0.0 109.661 178.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -105.42 30.19 5.88 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.208 -0.932 . . . . 0.0 110.723 179.261 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -113.11 167.26 10.69 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 120.905 -1.122 . . . . 0.0 110.104 179.854 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.07 156.28 28.72 Favored 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.113 -0.992 . . . . 0.0 110.083 -179.853 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -85.32 -34.21 21.91 Favored 'General case' 0 N--CA 1.506 2.353 0 O-C-N 121.197 -0.939 . . . . 0.0 110.584 179.802 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -51.1 -35.89 37.54 Favored 'General case' 0 N--CA 1.514 2.757 0 O-C-N 120.896 -1.128 . . . . 0.0 110.872 -179.84 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.9 p -107.9 118.6 37.16 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.1 -1.0 . . . . 0.0 110.028 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 41.9 mttt -115.85 143.96 44.69 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.149 -0.97 . . . . 0.0 110.296 -179.949 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.01 139.42 53.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.242 -0.911 . . . . 0.0 110.055 -179.991 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.3 mt 54.07 98.25 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.15 0 O-C-N 121.232 -0.917 . . . . 0.0 110.689 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -109.51 134.63 51.66 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.228 -0.92 . . . . 0.0 109.544 179.339 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.405 ' HA ' HG21 ' A' ' 94' ' ' ILE . 0.2 OUTLIER 54.37 -165.36 0.1 Allowed 'General case' 0 N--CA 1.501 2.125 0 O-C-N 120.956 -1.09 . . . . 0.0 110.203 -179.534 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.81 HD11 HG22 ' A' ' 90' ' ' ILE . 0.3 OUTLIER -116.16 -172.41 2.17 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.122 -0.986 . . . . 0.0 110.201 179.872 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.627 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.7 OUTLIER 46.9 37.1 4.51 Favored 'General case' 0 N--CA 1.504 2.249 0 O-C-N 121.114 -0.992 . . . . 0.0 111.296 -179.577 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.783 ' HB3' HD23 ' A' ' 76' ' ' LEU . 10.4 tt0 -109.81 -58.3 2.07 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.153 -0.967 . . . . 0.0 109.652 179.579 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.783 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.2 pt? -145.23 62.2 1.29 Allowed 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.093 -1.004 . . . . 0.0 109.861 178.668 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.67 ' HB2' HG22 ' A' ' 8' ' ' VAL . 12.4 pt-20 -143.92 140.82 29.92 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 120.8 -1.188 . . . . 0.0 110.867 179.321 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -71.77 70.27 0.95 Allowed Glycine 0 N--CA 1.495 2.578 0 N-CA-C 108.829 -1.708 . . . . 0.0 108.829 179.089 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.627 ' CE2' HG22 ' A' ' 74' ' ' THR . 61.8 p-90 -90.58 -23.4 20.86 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 121.23 -1.159 . . . . 0.0 111.644 -179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -52.47 -34.41 48.94 Favored 'General case' 0 N--CA 1.515 2.787 0 O-C-N 120.685 -1.259 . . . . 0.0 110.285 179.45 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -83.68 -39.03 20.71 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.088 -1.007 . . . . 0.0 109.635 178.972 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.12 177.21 0.02 OUTLIER 'General case' 0 N--CA 1.515 2.807 0 O-C-N 121.046 -1.034 . . . . 0.0 110.42 179.787 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -101.31 160.56 14.31 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.137 -0.977 . . . . 0.0 110.413 179.855 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -60.7 -42.9 98.12 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 121.26 -0.9 . . . . 0.0 110.101 -179.888 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -62.69 -41.8 99.3 Favored 'General case' 0 N--CA 1.507 2.393 0 C-N-CA 119.539 -0.865 . . . . 0.0 109.751 179.839 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.402 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 71.4 mt-10 -67.52 -40.56 85.1 Favored 'General case' 0 N--CA 1.506 2.332 0 C-N-CA 119.523 -0.871 . . . . 0.0 109.253 179.109 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 31.4 tttt -61.3 -38.91 88.52 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 121.305 -0.872 . . . . 0.0 109.814 179.343 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -58.77 -39.75 81.93 Favored 'General case' 0 N--CA 1.509 2.489 0 O-C-N 121.258 -0.901 . . . . 0.0 109.922 179.743 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.5 mt-30 -60.52 -35.73 76.68 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.152 -0.967 . . . . 0.0 110.362 179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.81 HG22 HD11 ' A' ' 73' ' ' LEU . 47.7 mm -69.28 -39.2 78.78 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.451 0 O-C-N 121.084 -1.01 . . . . 0.0 109.371 179.561 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 73.5 p -61.31 -39.18 89.52 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 121.023 -1.048 . . . . 0.0 109.603 179.257 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -57.61 -36.85 72.32 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.153 -0.967 . . . . 0.0 109.906 179.226 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.522 ' ND1' HG22 ' A' ' 53' ' ' ILE . 12.7 m-70 -59.37 -53.43 58.29 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.127 -0.983 . . . . 0.0 109.878 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.468 ' CD1' HD12 ' A' ' 73' ' ' LEU . 2.4 mp -63.29 -38.55 82.42 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.456 0 C-N-CA 119.407 -0.917 . . . . 0.0 109.435 179.616 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -69.4 -37.24 77.42 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.182 -0.949 . . . . 0.0 109.9 179.198 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -70.73 -38.4 73.56 Favored 'General case' 0 N--CA 1.507 2.402 0 O-C-N 121.13 -0.981 . . . . 0.0 109.712 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 4.5 tp -78.9 -32.75 45.91 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.116 -0.99 . . . . 0.0 110.315 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 44.8 t -96.01 54.03 1.43 Allowed 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.98 -1.075 . . . . 0.0 110.193 179.79 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 5.0 m -120.93 40.22 3.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.126 -0.984 . . . . 0.0 110.227 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -136.54 134.38 37.45 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.193 -0.942 . . . . 0.0 110.213 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -135.14 102.03 5.06 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.228 -0.92 . . . . 0.0 110.217 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.0 54.76 1.73 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.208 -0.932 . . . . 0.0 110.238 179.971 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 72.65 79.19 0.48 Allowed Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 24.0 p -125.69 150.38 68.2 Favored Pre-proline 0 N--CA 1.494 1.759 0 O-C-N 121.291 -1.123 . . . . 0.0 110.275 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -72.76 175.72 9.91 Favored 'Trans proline' 0 C--N 1.317 -1.103 0 O-C-N 123.487 1.256 . . . . 0.0 110.434 179.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 21.3 mtmt -129.8 72.35 1.48 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.206 -0.934 . . . . 0.0 110.212 -179.919 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 13.0 tttt 52.38 38.97 26.54 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 120.979 -1.076 . . . . 0.0 110.758 -179.916 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -142.45 126.83 17.7 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.222 -0.924 . . . . 0.0 110.205 -179.953 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -119.92 104.88 10.55 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.171 -0.956 . . . . 0.0 110.225 -179.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.3 t -130.12 99.99 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.308 -0.87 . . . . 0.0 109.968 179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.7 m -138.17 143.12 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.263 -0.898 . . . . 0.0 110.276 -179.936 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -129.49 90.38 2.99 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.237 -0.914 . . . . 0.0 110.247 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -118.75 123.13 44.08 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.15 -0.969 . . . . 0.0 110.236 -179.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 63.5 mmtt -123.57 102.37 7.82 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.168 -0.958 . . . . 0.0 110.288 179.927 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 8.2 tp -122.4 111.97 17.51 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.191 -0.943 . . . . 0.0 110.158 -179.883 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.5 t -141.84 146.87 36.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.193 -0.942 . . . . 0.0 110.319 -179.971 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . 0.517 ' O ' HG22 ' A' ' 117' ' ' THR . 25.6 m . . . . . 0 N--CA 1.501 2.112 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.782 179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 33.3 mtp . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 110.227 -0.286 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -122.78 175.54 6.48 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.162 -0.961 . . . . 0.0 110.183 179.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -146.12 85.97 1.69 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.18 -0.95 . . . . 0.0 110.503 -179.897 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.1 mt-30 -117.88 159.38 23.2 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.169 -0.957 . . . . 0.0 110.019 179.842 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -132.22 145.04 51.05 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.187 -0.946 . . . . 0.0 110.503 -179.948 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.522 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -150.24 137.6 19.66 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.286 -0.884 . . . . 0.0 109.726 -179.94 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.46 ' O ' HG23 ' A' ' 32' ' ' ILE . 1.7 m -153.3 157.03 39.5 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.157 -0.964 . . . . 0.0 110.258 179.193 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 77' ' ' GLU . 5.7 m -100.98 135.09 38.84 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.308 0 O-C-N 121.004 -1.06 . . . . 0.0 110.505 179.637 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -135.52 157.71 46.21 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.335 -0.853 . . . . 0.0 110.133 179.664 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.441 ' OH ' ' HG2' ' A' ' 86' ' ' GLU . 0.2 OUTLIER -107.17 154.91 20.5 Favored 'General case' 0 N--CA 1.498 1.955 0 O-C-N 121.407 -0.808 . . . . 0.0 110.085 -179.958 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -93.97 133.07 37.79 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 121.319 -0.863 . . . . 0.0 110.061 179.76 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.51 -55.44 2.44 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.27 -0.894 . . . . 0.0 110.456 -179.805 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.1 ttt-85 -138.51 105.87 5.53 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.166 -0.959 . . . . 0.0 110.29 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 136.75 151.56 6.04 Favored Glycine 0 N--CA 1.492 2.407 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.421 HG23 HG12 ' A' ' 26' ' ' VAL . 83.8 m -116.11 142.23 47.09 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.226 -1.161 . . . . 0.0 110.033 179.897 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -138.23 129.74 27.78 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.141 -0.974 . . . . 0.0 110.754 -179.889 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -63.77 122.19 25.56 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.968 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 14.9 t -61.24 129.91 43.62 Favored 'General case' 0 N--CA 1.509 2.511 0 O-C-N 121.244 -1.151 . . . . 0.0 109.441 179.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.441 ' HB3' ' CE1' ' A' ' 51' ' ' TYR . 14.9 tptt -61.98 147.42 47.05 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 121.169 -0.957 . . . . 0.0 109.168 179.827 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.2 mtpt 52.29 48.45 22.63 Favored 'General case' 0 N--CA 1.503 2.222 0 O-C-N 121.05 -1.031 . . . . 0.0 109.776 -179.259 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 38.5 t -164.43 155.75 15.58 Favored 'General case' 0 N--CA 1.497 1.924 0 O-C-N 121.342 -0.849 . . . . 0.0 110.736 -178.147 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.87 44.25 1.04 Allowed 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.27 -0.894 . . . . 0.0 108.604 178.629 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -143.35 -174.65 4.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.447 -0.783 . . . . 0.0 110.198 -179.045 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -136.46 156.62 48.35 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.091 -1.006 . . . . 0.0 109.743 -179.516 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.687 HG23 ' CG1' ' A' ' 29' ' ' VAL . 49.4 mt -97.58 121.56 48.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 C-N-CA 119.695 -0.802 . . . . 0.0 109.645 179.875 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.421 HG12 HG23 ' A' ' 15' ' ' THR . 34.1 m -129.51 176.45 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.331 -0.855 . . . . 0.0 110.6 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 22.0 mtpt -43.64 125.88 4.26 Favored 'General case' 0 N--CA 1.517 2.921 0 O-C-N 121.784 -0.573 . . . . 0.0 111.334 -179.544 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.16 8.58 50.2 Favored Glycine 0 N--CA 1.492 2.417 0 C-N-CA 120.151 -1.023 . . . . 0.0 110.955 -179.212 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.687 ' CG1' HG23 ' A' ' 25' ' ' ILE . 54.9 t -122.07 134.45 65.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 CA-C-N 119.562 1.681 . . . . 0.0 109.869 179.941 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.701 ' HB3' HD11 ' A' ' 53' ' ' ILE . 51.4 t -96.36 138.03 34.56 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.25 -0.906 . . . . 0.0 108.64 178.516 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.525 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.9 ptt85 -136.05 151.05 49.45 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.128 -0.982 . . . . 0.0 111.151 -178.924 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.46 HG23 ' O ' ' A' ' 7' ' ' CYS . 20.5 mt -105.01 137.0 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 O-C-N 121.26 -0.9 . . . . 0.0 109.832 179.873 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.411 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -107.13 127.16 8.7 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 108.934 -1.666 . . . . 0.0 108.934 179.658 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB3' ' CE1' ' A' ' 6' ' ' PHE . 49.6 pttt -110.89 124.05 51.32 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.154 -1.203 . . . . 0.0 110.08 -179.84 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.2 t -112.72 107.99 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 O-C-N 120.918 -1.114 . . . . 0.0 110.121 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 62.9 t -122.39 112.23 31.38 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.225 -0.922 . . . . 0.0 109.919 179.799 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.74 127.19 12.08 Favored 'Trans proline' 0 C--N 1.318 -1.059 0 O-C-N 123.198 1.104 . . . . 0.0 110.206 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -104.18 118.85 55.91 Favored Pre-proline 0 N--CA 1.499 1.982 0 O-C-N 121.112 -0.992 . . . . 0.0 110.162 179.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.23 71.45 2.97 Favored 'Trans proline' 0 N--CA 1.484 0.939 0 O-C-N 123.133 1.07 . . . . 0.0 110.304 179.875 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -145.87 -58.77 0.32 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.184 -0.947 . . . . 0.0 110.427 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 t -108.1 157.42 18.29 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.076 -1.015 . . . . 0.0 110.222 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -95.65 -39.09 10.08 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.26 -0.9 . . . . 0.0 110.36 -179.98 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -39.62 76.48 Favored 'General case' 0 N--CA 1.51 2.556 0 O-C-N 121.09 -1.007 . . . . 0.0 110.243 -179.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -108.04 81.31 0.29 Allowed Glycine 0 N--CA 1.493 2.499 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 179.937 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -73.63 -69.38 1.4 Allowed Glycine 0 N--CA 1.493 2.467 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 -179.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -116.49 133.88 55.51 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.148 -1.207 . . . . 0.0 110.256 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 37.5 mtt -117.52 138.49 51.86 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.169 -0.957 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.7 ttmm -117.23 125.77 51.69 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.187 -0.945 . . . . 0.0 109.996 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -114.81 134.6 54.99 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.181 -0.95 . . . . 0.0 109.946 179.91 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CD2' ' HD2' ' A' ' 31' ' ' ARG . 42.2 m95 -93.09 126.93 38.43 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.31 -0.869 . . . . 0.0 109.655 179.621 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.448 ' OH ' ' CE ' ' A' ' 34' ' ' LYS . 98.1 m-85 -112.2 174.66 5.77 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.289 -0.882 . . . . 0.0 110.616 -179.477 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.401 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 1.1 m170 -92.64 -172.35 3.02 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.842 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.93 HG22 ' CE1' ' A' ' 93' ' ' HIS . 35.2 mm -83.74 -41.62 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.18 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.928 178.828 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -89.13 -24.29 22.26 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.01 -1.056 . . . . 0.0 111.384 179.164 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.401 ' SG ' ' HB2' ' A' ' 52' ' ' HIS . 60.8 m -75.8 -41.44 52.81 Favored 'General case' 0 N--CA 1.507 2.414 0 O-C-N 120.638 -1.289 . . . . 0.0 110.198 -179.946 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -36.24 67.71 Favored 'General case' 0 N--CA 1.505 2.316 0 C-N-CA 119.399 -0.92 . . . . 0.0 110.446 -179.679 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.446 ' CZ ' HG13 ' A' ' 94' ' ' ILE . 11.2 m-85 -80.89 -31.69 35.13 Favored 'General case' 0 N--CA 1.501 2.111 0 C-N-CA 119.024 -1.07 . . . . 0.0 109.737 179.089 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -78.79 -33.42 46.28 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.032 -1.042 . . . . 0.0 109.677 178.153 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -72.95 -33.39 65.88 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 121.028 -1.045 . . . . 0.0 109.979 179.224 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.469 HD11 ' O ' ' A' ' 68' ' ' LYS . 2.9 tp -75.24 -40.15 59.25 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.033 -1.042 . . . . 0.0 109.443 179.291 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -73.5 -30.28 63.03 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.219 -0.925 . . . . 0.0 110.324 178.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.75 -30.47 14.24 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.036 -1.04 . . . . 0.0 111.003 179.918 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 59' ' ' LYS . . . -121.95 106.57 11.35 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.907 -1.121 . . . . 0.0 110.429 -179.567 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 1.5 ttp-105 -119.84 102.74 8.79 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.247 -0.908 . . . . 0.0 110.241 179.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -89.15 -35.97 15.95 Favored 'General case' 0 N--CA 1.506 2.333 0 O-C-N 121.145 -0.972 . . . . 0.0 110.424 179.66 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 68.1 p -131.38 -168.04 1.95 Allowed 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.102 -0.999 . . . . 0.0 109.625 -179.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -86.6 98.46 11.1 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 120.983 -1.073 . . . . 0.0 109.722 179.737 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.469 ' O ' HD11 ' A' ' 60' ' ' LEU . 17.1 ttpt -143.96 113.72 7.16 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.289 -0.882 . . . . 0.0 110.108 -179.958 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 2.5 tptm -140.34 138.33 34.79 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.214 -0.929 . . . . 0.0 110.556 -179.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.5 mt -112.51 113.83 45.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.292 -0.88 . . . . 0.0 109.66 179.595 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.414 ' HA ' ' CG2' ' A' ' 94' ' ' ILE . 12.7 mt-10 -110.48 155.04 22.79 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.185 -0.947 . . . . 0.0 110.391 -179.777 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.563 ' N ' HG21 ' A' ' 94' ' ' ILE . 0.8 OUTLIER 50.95 -175.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.06 -1.025 . . . . 0.0 110.897 -179.983 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.673 HD23 ' HG3' ' A' ' 87' ' ' LYS . 15.2 tp -125.61 37.92 4.27 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.281 -0.887 . . . . 0.0 110.575 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.614 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.6 OUTLIER -145.64 39.19 1.15 Allowed 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.189 -0.945 . . . . 0.0 110.306 179.661 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.504 ' HB2' HD23 ' A' ' 76' ' ' LEU . 13.9 mt-10 -109.75 -58.61 2.03 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 121.204 -0.935 . . . . 0.0 109.581 179.452 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.631 HD23 ' N ' ' A' ' 76' ' ' LEU . 1.3 pt? -145.28 62.69 1.29 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.235 -0.916 . . . . 0.0 109.591 178.731 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.726 ' HB2' HG22 ' A' ' 8' ' ' VAL . 0.7 OUTLIER -145.86 141.0 27.45 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.902 -1.124 . . . . 0.0 111.062 179.394 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -76.89 69.24 2.45 Favored Glycine 0 N--CA 1.496 2.675 0 N-CA-C 108.943 -1.663 . . . . 0.0 108.943 179.227 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.614 ' CE2' HG22 ' A' ' 74' ' ' THR . 61.7 p-90 -89.08 -23.49 22.51 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 121.248 -1.148 . . . . 0.0 111.783 -179.812 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -52.12 -33.55 40.41 Favored 'General case' 0 N--CA 1.513 2.719 0 O-C-N 120.581 -1.324 . . . . 0.0 110.692 179.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -80.73 -38.43 28.77 Favored 'General case' 0 N--CA 1.507 2.399 0 O-C-N 120.953 -1.092 . . . . 0.0 109.817 179.173 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.403 ' CD2' ' CD1' ' A' ' 90' ' ' ILE . 0.2 OUTLIER -50.88 177.58 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.854 0 O-C-N 121.139 -0.976 . . . . 0.0 110.686 -179.991 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -102.75 160.45 14.58 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.122 -0.986 . . . . 0.0 110.355 179.823 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -60.94 -43.5 98.6 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.259 -0.9 . . . . 0.0 110.177 -179.819 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -61.27 -50.57 72.49 Favored 'General case' 0 N--CA 1.508 2.444 0 O-C-N 121.27 -0.893 . . . . 0.0 109.56 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.441 ' HG2' ' OH ' ' A' ' 10' ' ' TYR . 1.2 mp0 -62.92 -41.04 99.34 Favored 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 119.475 -0.89 . . . . 0.0 109.157 178.975 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.673 ' HG3' HD23 ' A' ' 73' ' ' LEU . 1.3 ttpm? -60.09 -38.46 82.98 Favored 'General case' 0 N--CA 1.507 2.379 0 O-C-N 121.35 -0.844 . . . . 0.0 110.005 179.324 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -64.84 -39.14 93.09 Favored 'General case' 0 N--CA 1.507 2.425 0 O-C-N 121.227 -0.92 . . . . 0.0 110.065 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -66.86 -39.82 87.69 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.103 -0.998 . . . . 0.0 110.006 179.791 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.428 HD12 ' HA ' ' A' ' 87' ' ' LYS . 13.6 mt -66.13 -39.73 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.359 0 O-C-N 121.197 -0.939 . . . . 0.0 109.395 179.45 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -59.49 -37.9 79.46 Favored 'General case' 0 N--CA 1.508 2.426 0 O-C-N 121.171 -0.956 . . . . 0.0 109.955 179.492 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -58.29 -39.86 80.41 Favored 'General case' 0 N--CA 1.51 2.568 0 O-C-N 121.194 -0.942 . . . . 0.0 109.814 179.454 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.93 ' CE1' HG22 ' A' ' 53' ' ' ILE . 1.9 m-70 -58.84 -50.83 72.52 Favored 'General case' 0 N--CA 1.51 2.548 0 O-C-N 121.178 -0.951 . . . . 0.0 110.076 179.813 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.563 HG21 ' N ' ' A' ' 72' ' ' ASP . 4.1 mt -58.88 -38.4 72.73 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.521 0 O-C-N 121.18 -0.95 . . . . 0.0 110.015 179.851 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -60.65 -38.89 86.32 Favored 'General case' 0 N--CA 1.509 2.48 0 O-C-N 121.164 -0.96 . . . . 0.0 109.681 179.276 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -59.81 -46.2 89.98 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 121.168 -0.958 . . . . 0.0 109.596 179.543 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 5.4 mp -57.21 -34.26 68.36 Favored 'General case' 0 N--CA 1.51 2.545 0 O-C-N 121.116 -0.99 . . . . 0.0 110.381 179.589 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 21.2 m -97.93 51.41 1.04 Allowed 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.03 -1.044 . . . . 0.0 110.095 179.863 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 78.1 p -142.28 120.33 12.11 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.189 -0.945 . . . . 0.0 110.1 179.926 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.9 tppt? 53.16 72.1 0.45 Allowed 'General case' 0 N--CA 1.502 2.134 0 O-C-N 121.052 -1.03 . . . . 0.0 110.766 -179.863 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -117.35 -57.08 2.18 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.126 -0.984 . . . . 0.0 110.286 180.0 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -115.67 155.86 26.95 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.181 -0.949 . . . . 0.0 110.174 179.916 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -82.26 153.34 32.02 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 -179.891 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.06 96.45 49.33 Favored Pre-proline 0 N--CA 1.494 1.761 0 O-C-N 121.246 -1.149 . . . . 0.0 110.209 179.989 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.27 74.65 2.5 Favored 'Trans proline' 0 C--N 1.316 -1.135 0 O-C-N 123.421 1.221 . . . . 0.0 110.376 179.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 16.4 mtmt -141.89 145.93 35.17 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.199 -0.938 . . . . 0.0 110.182 -179.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.92 -63.92 1.13 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.208 -0.933 . . . . 0.0 110.325 -179.964 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.97 40.93 1.67 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.178 -0.951 . . . . 0.0 110.272 -179.969 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -129.45 127.79 41.61 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.159 -0.963 . . . . 0.0 110.157 179.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 8.9 p -130.9 147.69 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 O-C-N 121.133 -0.98 . . . . 0.0 110.227 -179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 34.9 m -135.67 143.05 37.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.153 -0.967 . . . . 0.0 110.244 179.936 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -117.59 116.38 26.97 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.164 -0.96 . . . . 0.0 110.266 -179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -132.12 118.6 19.82 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.187 -0.945 . . . . 0.0 110.23 179.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -119.72 117.42 28.2 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.208 -0.933 . . . . 0.0 110.214 -179.962 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 17.8 mt -125.67 138.18 53.89 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.28 -0.887 . . . . 0.0 110.17 -179.986 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 7.3 m -121.91 140.86 51.9 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.298 -0.876 . . . . 0.0 110.232 179.964 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.494 1.74 0 CA-C-O 118.023 -0.989 . . . . 0.0 110.232 -179.997 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.7 mtp . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.7 80.83 1.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.192 -0.942 . . . . 0.0 110.292 -179.916 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.3 pm0 -134.79 49.66 2.21 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.132 -0.98 . . . . 0.0 110.294 179.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.2 mp0 -142.42 117.09 9.78 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.182 -0.948 . . . . 0.0 110.22 179.796 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -117.51 146.84 43.28 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.138 -0.976 . . . . 0.0 110.329 179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.668 ' CD1' HD11 ' A' ' 70' ' ' ILE . 0.7 OUTLIER -140.28 136.82 33.68 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.317 -0.864 . . . . 0.0 109.88 -179.882 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.512 ' O ' HG23 ' A' ' 32' ' ' ILE . 4.1 m -151.74 160.85 43.44 Favored 'General case' 0 N--CA 1.504 2.234 0 O-C-N 121.198 -0.939 . . . . 0.0 110.056 178.942 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.6 HG22 ' HB2' ' A' ' 77' ' ' GLU . 8.3 m -101.41 120.9 51.63 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.996 -1.065 . . . . 0.0 110.638 179.788 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -114.24 146.85 39.87 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.207 -0.933 . . . . 0.0 109.445 179.298 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.575 ' CD2' HD13 ' A' ' 82' ' ' LEU . 0.2 OUTLIER -100.22 147.16 26.03 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.187 -0.946 . . . . 0.0 109.518 179.854 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.484 ' HB2' HG22 ' A' ' 25' ' ' ILE . . . -83.99 128.18 34.37 Favored 'General case' 0 N--CA 1.504 2.252 0 C-N-CA 119.227 -0.989 . . . . 0.0 110.008 179.987 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -151.77 38.02 0.59 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.176 -0.952 . . . . 0.0 110.77 179.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.58 50.82 0.18 Allowed 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.183 -0.948 . . . . 0.0 110.887 -179.899 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 103.41 -147.88 16.92 Favored Glycine 0 N--CA 1.493 2.49 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.9 t -133.42 149.17 51.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.27 -1.136 . . . . 0.0 110.333 -179.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -130.4 132.09 45.6 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.206 -0.934 . . . . 0.0 110.678 -179.963 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.73 121.9 28.17 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 179.835 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.401 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . 34.8 t -62.78 137.54 58.29 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.324 -1.103 . . . . 0.0 110.298 -179.334 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.9 mmtp -88.48 152.84 21.61 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 177.596 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 61.71 33.18 18.11 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 120.862 -1.149 . . . . 0.0 109.824 -178.413 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 179.59 150.78 0.35 Allowed 'General case' 0 N--CA 1.517 2.893 0 O-C-N 120.827 -1.17 . . . . 0.0 109.373 179.77 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtmt -93.96 67.58 3.73 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 121.155 -0.965 . . . . 0.0 109.773 179.793 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -149.86 -176.27 5.36 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.256 -0.902 . . . . 0.0 110.403 -179.366 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mtpt -132.67 150.9 52.09 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.952 -1.092 . . . . 0.0 109.881 -179.236 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.704 HG23 ' CG2' ' A' ' 29' ' ' VAL . 13.4 mt -104.21 98.29 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.842 0 O-C-N 121.361 -0.837 . . . . 0.0 109.167 179.517 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 49.0 t -85.19 157.61 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.323 0 O-C-N 121.305 -0.872 . . . . 0.0 110.514 -179.429 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 3.2 ptmt -51.3 123.56 9.88 Favored 'General case' 0 N--CA 1.511 2.576 0 O-C-N 121.261 -0.899 . . . . 0.0 110.725 -179.605 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 119.19 -18.15 10.38 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 119.937 -1.125 . . . . 0.0 111.363 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.704 ' CG2' HG23 ' A' ' 25' ' ' ILE . 4.4 m -98.9 135.02 35.58 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 CA-C-N 119.584 1.692 . . . . 0.0 110.367 -179.51 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.425 ' HB3' ' CE1' ' A' ' 10' ' ' TYR . 28.4 p -79.55 131.65 36.08 Favored 'General case' 0 N--CA 1.505 2.315 0 C-N-CA 119.393 -0.923 . . . . 0.0 109.934 179.851 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.518 ' HD3' HD13 ' A' ' 25' ' ' ILE . 4.4 ptt-85 -132.81 149.71 52.24 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.278 -0.889 . . . . 0.0 110.091 -179.852 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.512 HG23 ' O ' ' A' ' 7' ' ' CYS . 17.5 mt -106.25 130.8 57.34 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 O-C-N 121.151 -0.968 . . . . 0.0 109.841 -179.875 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.435 ' HA3' ' CZ3' ' A' ' 50' ' ' TRP . . . -105.46 138.43 14.25 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 108.406 -1.878 . . . . 0.0 108.406 179.225 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.47 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 9.0 ttpt -107.15 108.96 20.67 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.184 -1.186 . . . . 0.0 109.469 -179.909 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.447 HG12 ' OD1' ' A' ' 46' ' ' ASP . 52.7 t -85.83 119.64 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.34 0 O-C-N 121.054 -1.029 . . . . 0.0 110.383 -179.755 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.425 HG21 ' HE3' ' A' ' 34' ' ' LYS . 60.9 t -121.41 112.04 33.04 Favored Pre-proline 0 N--CA 1.495 1.797 0 O-C-N 121.24 -0.912 . . . . 0.0 109.873 179.822 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -72.84 134.33 21.59 Favored 'Trans proline' 0 N--CA 1.485 1.012 0 O-C-N 123.141 1.074 . . . . 0.0 110.544 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -103.54 160.81 24.96 Favored Pre-proline 0 N--CA 1.499 1.994 0 O-C-N 121.217 -0.927 . . . . 0.0 110.094 179.698 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -73.19 140.08 30.37 Favored 'Trans proline' 0 C--N 1.316 -1.139 0 O-C-N 123.392 1.207 . . . . 0.0 110.358 179.933 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 55.3 100.49 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.1 -1.0 . . . . 0.0 110.591 -179.957 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.403 ' HB2' ' CA ' ' A' ' 45' ' ' GLY . 89.9 p -111.66 105.29 13.78 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.189 -0.944 . . . . 0.0 110.492 179.944 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -102.23 -54.78 2.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.239 -0.913 . . . . 0.0 109.832 179.467 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.43 -41.13 12.26 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.21 -0.931 . . . . 0.0 109.976 179.367 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -122.35 -111.51 2.11 Favored Glycine 0 N--CA 1.493 2.488 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.836 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.403 ' CA ' ' HB2' ' A' ' 41' ' ' SER . . . 143.12 -65.18 0.48 Allowed Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.961 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.447 ' OD1' HG12 ' A' ' 35' ' ' VAL . 1.2 t0 -114.94 133.23 56.18 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -1.165 . . . . 0.0 109.922 179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 5.6 mmt -117.3 144.41 44.9 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.182 -0.949 . . . . 0.0 110.523 -179.808 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -139.84 139.0 36.22 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.357 -0.839 . . . . 0.0 109.922 179.722 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -111.04 130.91 55.45 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.192 -0.942 . . . . 0.0 109.6 179.97 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.559 ' O ' HD11 ' A' ' 25' ' ' ILE . 7.8 m95 -89.91 113.54 25.18 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.19 -0.944 . . . . 0.0 109.627 179.768 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.47 ' OH ' ' HB2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -137.5 168.3 19.93 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 118.787 -1.165 . . . . 0.0 111.4 178.977 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 18' ' ' CYS . 60.4 m80 -71.89 158.15 36.56 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.57 -0.706 . . . . 0.0 109.769 -179.151 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.449 ' CG2' ' CD1' ' A' ' 57' ' ' PHE . 51.1 mt -61.67 -44.58 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.142 -0.974 . . . . 0.0 109.264 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.28 -31.4 65.57 Favored 'General case' 0 N--CA 1.509 2.499 0 O-C-N 121.253 -0.905 . . . . 0.0 110.552 179.461 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 82.4 m -70.76 -41.08 72.22 Favored 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.024 -1.048 . . . . 0.0 109.749 179.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 9.9 tpt -76.31 -40.58 51.14 Favored 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 119.314 -0.954 . . . . 0.0 108.964 178.765 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.449 ' CD1' ' CG2' ' A' ' 53' ' ' ILE . 7.5 m-85 -64.68 -33.27 75.56 Favored 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 119.27 -0.972 . . . . 0.0 109.543 178.507 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -58.15 -39.6 79.22 Favored 'General case' 0 N--CA 1.51 2.528 0 O-C-N 120.986 -1.071 . . . . 0.0 109.833 179.36 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 17.5 tttp -63.61 -40.08 95.99 Favored 'General case' 0 N--CA 1.506 2.366 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.585 179.264 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.6 mp -57.95 -42.67 85.45 Favored 'General case' 0 N--CA 1.509 2.496 0 O-C-N 121.095 -1.003 . . . . 0.0 109.251 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -59.0 -35.46 73.28 Favored 'General case' 0 N--CA 1.508 2.435 0 O-C-N 121.234 -0.916 . . . . 0.0 109.327 178.501 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 4.1 ttt85 -105.78 31.53 4.96 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 179.092 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.18 169.23 9.01 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 120.902 -1.124 . . . . 0.0 110.013 179.958 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.48 155.7 17.69 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 121.176 -0.952 . . . . 0.0 110.241 -179.968 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.37 -33.84 70.04 Favored 'General case' 0 N--CA 1.51 2.534 0 O-C-N 121.218 -0.926 . . . . 0.0 110.578 -179.978 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . 2.5 p -52.53 -35.17 52.8 Favored 'General case' 0 N--CA 1.514 2.738 0 O-C-N 120.878 -1.139 . . . . 0.0 110.781 -179.843 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 29.7 p -114.49 107.65 15.81 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.053 -1.029 . . . . 0.0 110.385 179.998 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.9 mtpt -121.23 144.91 48.35 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.202 -0.936 . . . . 0.0 110.011 179.742 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 150.1 43.93 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.183 -0.948 . . . . 0.0 110.803 -179.84 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.709 ' HA ' HD21 ' A' ' 76' ' ' LEU . 77.9 mt 52.87 99.85 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 O-C-N 121.187 -0.946 . . . . 0.0 111.254 179.958 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.2 139.6 48.64 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.242 -0.911 . . . . 0.0 108.865 178.688 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 55.42 -163.74 0.14 Allowed 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.948 -1.095 . . . . 0.0 109.712 -179.249 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.552 ' C ' HD23 ' A' ' 73' ' ' LEU . 10.6 tt -106.49 -51.13 3.0 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.925 -1.109 . . . . 0.0 110.685 -179.845 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.402 HG22 ' CE2' ' A' ' 79' ' ' TRP . 0.2 OUTLIER -80.73 77.43 7.58 Favored 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.097 -1.002 . . . . 0.0 110.167 -179.829 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.757 ' HB3' HD23 ' A' ' 76' ' ' LEU . 29.2 tt0 -138.65 -58.61 0.62 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.131 -0.98 . . . . 0.0 110.499 179.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.757 HD23 ' HB3' ' A' ' 75' ' ' GLU . 1.5 pt? -147.62 60.05 1.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 120.972 -1.08 . . . . 0.0 110.805 179.208 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.6 ' HB2' HG22 ' A' ' 8' ' ' VAL . 10.0 pt-20 -145.2 140.71 28.09 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.81 -1.181 . . . . 0.0 110.71 178.42 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -74.27 69.33 1.67 Allowed Glycine 0 N--CA 1.497 2.709 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 179.449 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.402 ' CE2' HG22 ' A' ' 74' ' ' THR . 60.1 p-90 -91.47 -38.41 12.57 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 121.172 -1.193 . . . . 0.0 110.557 179.967 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -53.86 -28.3 35.21 Favored 'General case' 0 N--CA 1.511 2.601 0 O-C-N 121.08 -1.013 . . . . 0.0 111.261 -179.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -91.19 -36.22 14.07 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 120.872 -1.143 . . . . 0.0 110.877 -179.683 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.575 HD13 ' CD2' ' A' ' 10' ' ' TYR . 94.5 mt -69.08 -173.93 0.56 Allowed 'General case' 0 N--CA 1.507 2.389 0 O-C-N 120.989 -1.07 . . . . 0.0 109.848 -179.939 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -70.34 161.45 30.39 Favored 'General case' 0 N--CA 1.51 2.54 0 O-C-N 121.178 -0.952 . . . . 0.0 110.575 -179.562 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -77.6 -36.35 51.97 Favored 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.24 -0.912 . . . . 0.0 110.278 179.599 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -52.25 -37.53 55.55 Favored 'General case' 0 N--CA 1.514 2.749 0 O-C-N 120.989 -1.07 . . . . 0.0 110.126 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.425 ' HG3' ' CE2' ' A' ' 10' ' ' TYR . 0.7 OUTLIER -57.98 -40.57 80.98 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.205 -0.934 . . . . 0.0 109.311 178.812 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.3 -37.53 64.9 Favored 'General case' 0 N--CA 1.51 2.573 0 O-C-N 121.325 -0.859 . . . . 0.0 109.984 179.125 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -69.0 -41.42 77.84 Favored 'General case' 0 N--CA 1.506 2.335 0 O-C-N 121.257 -0.902 . . . . 0.0 109.27 179.139 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -64.95 -36.32 84.01 Favored 'General case' 0 N--CA 1.507 2.405 0 O-C-N 121.229 -0.919 . . . . 0.0 110.022 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 39.7 mm -63.94 -41.1 91.4 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.14 -0.975 . . . . 0.0 109.52 179.784 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 67.8 p -60.15 -38.77 84.15 Favored 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.112 -0.992 . . . . 0.0 110.105 179.986 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -58.42 -38.51 77.57 Favored 'General case' 0 N--CA 1.509 2.476 0 O-C-N 121.214 -0.929 . . . . 0.0 110.061 179.694 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.437 ' HB3' ' CZ ' ' A' ' 57' ' ' PHE . 8.0 m-70 -65.18 -53.52 43.54 Favored 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 119.344 -0.942 . . . . 0.0 109.552 179.708 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.77 -34.73 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.31 0 C-N-CA 119.191 -1.004 . . . . 0.0 109.25 179.004 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.3 -39.38 71.49 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.148 -0.97 . . . . 0.0 109.55 179.111 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.54 -37.85 85.88 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 121.213 -0.929 . . . . 0.0 109.663 179.244 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 17.6 tp -78.85 -29.74 44.76 Favored 'General case' 0 N--CA 1.506 2.344 0 O-C-N 121.154 -0.966 . . . . 0.0 110.718 179.461 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.2 m -103.6 39.39 1.61 Allowed 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.871 -1.143 . . . . 0.0 110.49 -179.807 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 22.3 m -155.07 55.66 0.65 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.146 -0.971 . . . . 0.0 110.608 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.8 tppt? -130.73 130.82 44.28 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.125 -0.985 . . . . 0.0 110.277 179.912 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -133.86 40.37 3.09 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.295 -0.878 . . . . 0.0 110.201 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -139.78 124.57 18.43 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.235 -0.915 . . . . 0.0 110.189 -179.96 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . 99.88 -54.0 0.95 Allowed Glycine 0 N--CA 1.494 2.527 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 3.7 m -123.04 93.4 48.32 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.189 -1.183 . . . . 0.0 110.122 -179.975 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -72.92 143.42 36.64 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 O-C-N 123.431 1.227 . . . . 0.0 110.455 -179.964 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 72.5 mttt -143.0 90.46 2.2 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.175 -0.953 . . . . 0.0 110.242 179.988 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.7 tptt -124.14 -61.29 1.37 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.156 -0.965 . . . . 0.0 110.186 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 14.6 tttt -149.8 101.13 3.03 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.13 -0.981 . . . . 0.0 110.57 -179.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -134.35 154.17 51.49 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.188 -0.945 . . . . 0.0 110.091 179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 7.9 p -130.17 145.73 35.17 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 O-C-N 121.136 -0.977 . . . . 0.0 110.394 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 60.6 t -140.61 144.12 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.094 -1.004 . . . . 0.0 110.042 -179.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -108.35 103.76 12.99 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.268 -0.895 . . . . 0.0 109.752 179.558 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -116.17 142.55 46.67 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.242 -0.911 . . . . 0.0 110.542 -179.529 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 24.3 mtpt -110.28 151.86 26.86 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.167 -0.958 . . . . 0.0 109.902 179.683 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 2.9 tp -105.37 110.15 22.39 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.24 -0.912 . . . . 0.0 110.323 -179.972 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 6.9 t -140.87 150.68 43.54 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.238 -0.914 . . . . 0.0 110.15 179.897 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 2.0 p . . . . . 0 N--CA 1.494 1.769 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.227 -179.962 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A 1118 ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_